isatoic anhydride
anthranilic acid, N-carboxy-, cyclic anhydride
 
Notes:
None found
  • BOC Sciences
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      118-48-9 1H-3,1-benzoxazine-2,4-quinone 96%
       
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      09-10400 ISATOIC ANHYDRIDE
       
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      Product(s):
      I0081 Isatoic Anhydride >98.0%(HPLC)(T)
       
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CAS Number: 118-48-9Picture of molecule3D/inchi
Other(deleted CASRN): 32779-11-6
ECHA EINECS - REACH Pre-Reg: 204-255-0
FDA UNII: R8TFA74Y4U
Nikkaji Web: J5.526C
Beilstein Number: 0136786
MDL: MFCD00006700
XlogP3-AA: 1.00 (est)
Molecular Weight: 163.13245000
Formula: C8 H5 N O3
BioActivity Summary: listing
NMR Predictor: Predict (works with chrome or firefox)
Category: pharmaceuticals / chemical synthisis
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar: Search
Google Books: Search
Google Scholar: with word "volatile"Search
Google Scholar: with word "flavor"Search
Google Scholar: with word "odor"Search
Google Patents: Search
US Patents: Search
EU Patents: Search
Pubchem Patents: Search
PubMed: Search
NCBI: Search
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Physical Properties:
Assay: 95.00 to 100.00 % 
Food Chemicals Codex Listed: No
Flash Point: 32.00 °F. TCC ( 0.00 °C. ) (est)
logP (o/w): 0.978 (est)
Soluble in:
 water, 401.9 mg/L @ 25 °C (est)
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Organoleptic Properties:
 
Odor and/or flavor descriptions from others (if found).
 
 
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Cosmetic Information:
None found
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Suppliers:
Anshul Specialty Molecules
Isatoic Anhydride
BOC Sciences
For experimental / research use only.
1H-3,1-benzoxazine-2,4-quinone 96%
BST Tianjin Co.
Isatoic Anhydride
EMD Millipore
For experimental / research use only.
Isatoic Anhydride
Penta International
ISATOIC ANHYDRIDE
Santa Cruz Biotechnology
For experimental / research use only.
Isatoic Anhydride
Sigma-Aldrich: Aldrich
For experimental / research use only.
Isatoic Anhydride 96%
TCI AMERICA
For experimental / research use only.
Isatoic Anhydride >98.0%(HPLC)(T)
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Safety Information:
Preferred SDS: View
 
Hazards identification
 
Classification of the substance or mixture
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)
None found.
GHS Label elements, including precautionary statements
 
Pictogram
 
Hazard statement(s)
None found.
Precautionary statement(s)
None found.
Oral/Parenteral Toxicity:
Not determined
Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
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Safety in Use Information:
Category: pharmaceuticals / chemical synthisis
Recommendation for isatoic anhydride usage levels up to:
 not for fragrance use.
 
Recommendation for isatoic anhydride flavor usage levels up to:
 not for flavor use.
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Safety References:
EPI System: View
AIDS Citations: Search
Cancer Citations: Search
Toxicology Citations: Search
EPA Substance Registry Services (TSCA): 118-48-9
EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 8359
National Institute of Allergy and Infectious Diseases: Data
WGK Germany: 1
 1H-3,1-benzoxazine-2,4-dione
Chemidplus: 0000118489
RTECS: DM3100000 for cas# 118-48-9
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References:
 1H-3,1-benzoxazine-2,4-dione
NIST Chemistry WebBook: Search Inchi
Pubchem (cid): 8359
Pubchem (sid): 134973875
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Other Information:
(IUPAC): Atomic Weights of the Elements 2011 (pdf)
Videos: The Periodic Table of Videos
tgsc: Atomic Weights use for this web site
(IUPAC): Periodic Table of the Elements
CHEMBL: View
HMDB (The Human Metabolome Database): Search
Export Tariff Code: 2934.99.4400
ChemSpider: View
Wikipedia: View
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Potential Blenders and core components note
 
None Found
 
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Potential Uses:
None Found
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Occurrence (nature, food, other): note
 not found in nature
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Synonyms:
 anthranilic acid N-carboxylic acid anhydride
 anthranilic acid, N-carboxy-, cyclic anhydride
1H-benzo[d][1,3]oxazine-2,4-dione
 benzoic acid, 2-(carboxyamino)-, cyclic anhydride
1H-3,1-benzoxazine-2,4-dione
1H-3,1-benzoxazine-2,4-quinone
2H-3,1-benzoxazine-2,4(1H)-dione
4H-3,1-benzoxazine-2,4(1H)-dione
 isatoic acid anhydride
 isatoicanhydride
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Articles:
PubMed: Efficient [Formula: see text]-catalyzed synthesis of novel and diverse 2,3-dihydroquinazolin-4(1[Formula: see text])-ones.
PubMed: Efficient synthesis of 2,3-disubstituted-2,3-dihydroquinazolin-4(1H)-ones catalyzed by dodecylbenzenesulfonic acid in aqueous media under ultrasound irradiation.
PubMed: Inorganic-organic hybrid silica based tin complex as a novel, highly efficient and recyclable heterogeneous catalyst for the one-pot preparation of spirooxindoles in water.
PubMed: One-pot synthesis of 2-amino-4(3H)-quinazolinones via ring-opening of isatoic anhydride and palladium-catalyzed oxidative isocyanide-insertion.
PubMed: Biotin-conjugated N-methylisatoic anhydride: a chemical tool for nucleic acid separation by selective 2'-hydroxyl acylation of RNA.
PubMed: Synthesis and biological evaluation of 2-aminobenzamide derivatives as antimicrobial agents: opening/closing pharmacophore site.
PubMed: N,N'-(Propane-1,3-di-yl)bis-(2-amino-benzamide).
PubMed: The folding of the hepatitis C virus internal ribosome entry site depends on the 3'-end of the viral genome.
PubMed: Palladium-catalyzed regioselective carbonylation of C-H bonds of N-alkyl anilines for synthesis of isatoic anhydrides.
PubMed: A highly efficient green synthesis of N-alkyl 2-[(2-oxo-2-aryl ethyl) amino] benzamide derivatives from reaction of isatoic anhydride, primary amines and 2-bromoacethophenone.
PubMed: Synthesis and cytotoxicity testing of new amido-substituted triazolopyrrolo[2,1-c][1,4]benzodiazepine (PBDT) derivatives.
PubMed: Hydrolase-like properties of a cofactor-independent dioxygenase.
PubMed: A new cascade reaction: concurrent construction of six and five membered rings leading to novel fused quinazolinones.
PubMed: Palladium-catalyzed decarboxylative coupling of isatoic anhydrides with arylboronic acids.
PubMed: 1,3-Dipolar cycloaddition-decarboxylation reactions of an azomethine ylide with isatoic anhydrides: formation of novel benzodiazepinones.
PubMed: Synthesis of 2,3-dihydroquinazolin-4(1H)-ones by three-component coupling of isatoic anhydride, amines, and aldehydes catalyzed by magnetic Fe(3)O(4) nanoparticles in water.
PubMed: Glycosylation, sugar hydrazones, and antimicrobial evaluation of some 6-substituted-1,2,4-triazines.
PubMed: Cytotoxicity and reversal of multidrug resistance by tryptanthrin-derived indoloquinazolines.
PubMed: Reactions of ortho-lithiophenyl (-hetaryl) isocyanides with carbonyl compounds: rearrangements of 2-metalated 4H-3,1-benzoxazines.
PubMed: Time-resolved RNA SHAPE chemistry.
PubMed: Novel and efficient one-pot tandem synthesis of 2-styryl-substituted 4(3H)-quinazolinones.
PubMed: Synthesis, NMR and crystallographic studies of 2-substituted dihydroquinazolinones derived from (S)-phenylethylamine.
PubMed: 96-well plate-to-plate gravity fluorous solid-phase extraction (F-SPE) for solution-phase library purification.
PubMed: Automated liquid-liquid extraction workstation for library synthesis and its use in the parallel and chromatography-free synthesis of 2-alkyl-3-alkyl-4-(3H)-quinazolinones.
PubMed: Hydrogen-bonding in 2-aminobenzoyl-alpha-chymotrypsin formed by acylation of the enzyme with isatoic anhydride: IR and mass spectroscopic studies.
PubMed: Practical synthesis of potential endothelin receptor antagonists of 1,4-benzodiazepine-2,5-dione derivatives bearing substituents at the C3-, N1- and N4-positions.
PubMed: Fluorous reagents and scavengers versus solid-supported reagents and scavengers, a reaction rate and kinetic comparison.
PubMed: Plate-to-plate fluorous solid-phase extraction for solution-phase parallel synthesis.
PubMed: A direct, continuous, sensitive assay for protein disulphide-isomerase based on fluorescence self-quenching.
PubMed: The energetics of isomeric benzoxazine diones: isatoic anhydride revisited.
PubMed: Are isatin and isatoic anhydride antiaromatic and aromatic respectively? A combined experimental and theoretical investigation.
PubMed: Synthesis and pharmacological activity of 1,4-benzodiazepine derivatives.
PubMed: An efficient, convenient synthesis of novel medium-sized 13H-dibenzo[d,h][1,3,7]oxadiazecine-8,14-dione macrolides as anticipated antineoplastic agents.
PubMed: Stereoselective Synthesis of Tilivalline(1).
PubMed: Structures of native and complexed complement factor D: implications of the atypical His57 conformation and self-inhibitory loop in the regulation of specific serine protease activity.
PubMed: Aminoacyl-tRNA analogues; synthesis, purification and properties of 3'-anthraniloyl oligoribonucleotides.
PubMed: Structure-activity relationships of a series of substituted benzamides: potent D2/5-HT2 antagonists and 5-HT1a agonists as neuroleptic agents.
PubMed: Preliminary synthetic studies of methyllycaconitine, a potent nicotinic acetylcholine receptor antagonist: rapid syntheses of AE-bicyclic analogues.
PubMed: Further search for small molecular inactivants capable of eliciting respiratory mucosal immunogenicity by modifying Sendai virus core RNA.
PubMed: Rates of thrombin acylation and deacylation upon reaction with low molecular weight acylating agents, carbamylating agents and carbonylating agents.
PubMed: [Polycyclic azines with heteroatoms in the 1- and 3-position. 40. Synthesis of heterocyclic immunomodulators. 3. Synthesis of n-1 substituted 3-(2-mercaptoethyl)quinazoline-2,4-(1H,3H)-diones from bis(2-(2-aminobenzoylamino)ethyl)disulfane and testing of immunostimulant activity].
PubMed: The kinetics of non-stoichiometric bursts of beta-lactam hydrolysis catalysed by class C beta-lactamases.
PubMed: Fluorescence properties of o-aminobenzoyl-labeled proteins.
PubMed: tRNA fluorescent labeling at 3' end inducing an aminoacyl-tRNA-like behavior.
PubMed: Inactivation of arginine esterase E-I of Bitis gabonica venom by irreversible inhibitors including a water-soluble carbodiimide, a chloromethyl ketone and isatoic anhydride.
PubMed: Biosynthesis and modulation of endothelin from bovine pulmonary arterial endothelial cells.
PubMed: Antihypertensive activity of 2[(2-hydroxyphenyl)amino]-4(3H)-quinazolinone.
PubMed: Substituted isatoic anhydrides: selective inactivators of trypsin-like serine proteases.
PubMed: Assessment of antiprotease activity of some carbamate derivatives.
PubMed: New ribose-modified fluorescent analogs of adenine and guanine nucleotides available as substrates for various enzymes.
PubMed: Suicide enzyme inactivators.
PubMed: New fluorescent analogs of cAMP and cGMP available as substrates for cyclic nucleotide phosphodiesterase.
PubMed: Nicafenine, a new analgesic. I. Synthesis and physicochemical properties.
PubMed: Aromatic amines condensed with aminothiazoles, directly and with isatoic anhydride, for schistosomiasis treatment I.
PubMed: Antifertility effects of isatoic anhydride and derivatives.
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