2-mercaptopyrimidine
2-thiopyrimidine
 
Notes:
None found
  • BOC Sciences
    • BOC Sciences
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      Product(s):
      1450-85-7 2-pyrimidinethiol 95%
       
  • TCI AMERICA
    • TCI AMERICA
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      Product(s):
      M0937 2-Mercaptopyrimidine >98.0%(HPLC)
       
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CAS Number: 1450-85-7Picture of molecule3D/inchi
Other(deleted CASRN): 107646-94-6
ECHA EINECS - REACH Pre-Reg: 215-917-3
FDA UNII: Search
Nikkaji Web: J208.747B
Beilstein Number: 107105
MDL: MFCD00006073
XlogP3: -1.10 (est)
Molecular Weight: 112.15488000
Formula: C4 H4 N2 S
BioActivity Summary: listing
NMR Predictor: Predict (works with chrome, Edge or firefox)
Category: information only not used for fragrances or flavors
 
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:
Appearance: colorless to amber brown crystalline solid (est)
Assay: 95.00 to 100.00 % 
Food Chemicals Codex Listed: No
Melting Point: 230.00 °C. @ 760.00 mm Hg
Boiling Point: 191.00 to  192.00 °C. @ 760.00 mm Hg (est)
Vapor Pressure: 0.082000 mmHg @ 25.00 °C. (est)
Flash Point: 204.00 °F. TCC ( 95.40 °C. ) (est)
logP (o/w): 0.981 (est)
Soluble in:
 alcohol
 water, 3.083e+004 mg/L @ 25 °C (est)
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Organoleptic Properties:
 
Odor Type: onion
 
 onion green onion  
Odor Description:
at 0.10 % in propylene glycol. 
penetrating sharp green onions
 
 
Flavor Type: onion
 
 onion green onion  
Taste Description:
burning onions
 
Odor and/or flavor descriptions from others (if found).
 
 
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Cosmetic Information:
None found
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Suppliers:
BOC Sciences
For experimental / research use only.
2-pyrimidinethiol 95%
EMD Millipore
For experimental / research use only.
2-Mercaptopyrimidine
Santa Cruz Biotechnology
For experimental / research use only.
2-Mercaptopyrimidine
Sigma-Aldrich: Aldrich
For experimental / research use only.
2-Mercaptopyrimidine 98%
TCI AMERICA
For experimental / research use only.
2-Mercaptopyrimidine >98.0%(HPLC)
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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: information only not used for fragrances or flavors
Recommendation for 2-mercaptopyrimidine usage levels up to:
 not for fragrance use.
 
Recommendation for 2-mercaptopyrimidine 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): 1450-85-7
EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 1550489
National Institute of Allergy and Infectious Diseases: Data
WISER: UN 3335
WGK Germany: 3
 1H-pyrimidine-2-thione
Chemidplus: 0001450857
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References:
 1H-pyrimidine-2-thione
NIST Chemistry WebBook: Search Inchi
Pubchem (cid): 1550489
Pubchem (sid): 135029709
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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
CHEBI: View
CHEMBL: View
HMDB (The Human Metabolome Database): Search
Export Tariff Code: 2933.59.9500
ChemSpider: View
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Potential Blenders and core components note
 
None Found
 
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Potential Uses:
 greenFR
 onionFL
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Occurrence (nature, food, other): note
 not found in nature
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Synonyms:
 pyrimidine-2-thiol
 pyrimidine-2-thione
1H-pyrimidine-2-thione
 pyrimidine-2(1H)-thione
2-pyrimidinethiol
2-pyrimidinethione
2(1H)-pyrimidinethione
2-thiopyrimidine
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