Articles:
bicyclo[2.2.1]heptan-2-one, 1,7,7-trimethyl-, (1S)-
Notes:
None found
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| CAS Number: | 464-48-2 |  3D/inchi
|
| ECHA EINECS - REACH Pre-Reg: | 207-354-7 | |
| FDA UNII: | 213N3S8275 | |
| Beilstein Number: | 1907612 | |
| MDL: | MFCD00064148 | |
| XlogP3-AA: | 2.20 (est) | |
| Molecular Weight: | 152.23672000 | |
| Formula: | C10 H16 O | |
| NMR Predictor: | Predict (works with chrome or firefox) | |
Category: flavor and fragrance agents
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 |
| Perfumer and Flavorist: | Search |
| Google Patents: | Search |
| US Patents: | Search |
| EU Patents: | Search |
| Pubchem Patents: | Search |
| PubMed: | Search |
| NCBI: | Search |
Physical Properties:
| Appearance: | white crystals (est) |
| Assay: | 97.00 to 100.00 % |
| Food Chemicals Codex Listed: | No |
| Optical Rotation: | -41.00 to -45.00 |
| Melting Point: | 178.00 to 180.00 °C. @ 760.00 mm Hg |
| Boiling Point: | 207.42 °C. @ 760.00 mm Hg (est) |
| Vapor Pressure: | 0.040000 mmHg @ 20.00 °C. |
| Vapor Density: | 5.24 ( Air = 1 ) |
| Flash Point: | 149.00 °F. TCC ( 65.00 °C. ) |
| logP (o/w): | 2.089 (est) |
| Soluble in: | |
| alcohol | |
| water, 339.1 mg/L @ 25 °C (est) | |
| Insoluble in: | |
| water | |
Organoleptic Properties:
| Odor Type: camphoreous | |
| Odor Strength: | medium , recommend smelling in a 10.00 % solution or less |
| camphoreous | |
| Odor Description: at 10.00 % in dipropylene glycol. | camphor |
| Odor and/or flavor descriptions from others (if found). | |
Cosmetic Information:
| None found |
Suppliers:
| BOC Sciences |
| For experimental / research use only. |
| L(-)-Camphor >96.0%(GC) |
| EMD Millipore |
| For experimental / research use only. |
| (1S)-(-)-Camphor |
| ExtraSynthese |
| For experimental / research use only. |
| (-)-Camphor (GC) ≥95% |
| Santa Cruz Biotechnology |
| For experimental / research use only. |
| (1S)-(-)-Camphor |
| Sigma-Aldrich: Aldrich |
| For experimental / research use only. |
| (1S)-(-)-Camphor 99% |
| TCI AMERICA |
| For experimental / research use only. |
| (-)-Camphor >96.0%(GC) |
Safety Information:
| Preferred SDS: View | |
| European information : | |
| Most important hazard(s): | |
| Xn - Harmful. | |
|
R 20/21/22 - Harmful by inhalation, in contact with skin and if swallowed. R 36/37/38 - Irritating to eyes, respiratory system, and skin. S 02 - Keep out of the reach of children. S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S 36 - Wear suitable protective clothing. | |
| 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: | |
|
oral-rat LD50 0.80 mg/kg Journal of Pharmacology and Experimental Therapeutics. Vol. 1, Pg. 445, 1909. intravenous-mouse LD50 320 mg/kg Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#02534 intravenous-mouse LD50 320 mg/kg U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#02534 oral-rat LDLo 800 ug/kg BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD Journal of Pharmacology and Experimental Therapeutics. Vol. 1, Pg. 445, 1909. | |
| Dermal Toxicity: | |
| Not determined | |
| Inhalation Toxicity: | |
| Not determined | |
Safety in Use Information:
| Category: | flavor and fragrance agents | ||
| IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice | |||
| Recommendation for laevo-camphor usage levels up to: | |||
| 5.0000 % in the fragrance concentrate. | |||
Safety References:
| European Food Safety Authority (EFSA) reference(s): | |
| Camphor in flavourings and other food ingredients with flavouring properties - Opinion of the Scientific Panel on Food Additives, Flavourings, Processing Aids and Materials in Contact with Food on a request from the Commission View page or View pdf | |
| EPI System: | View |
| AIDS Citations: | Search |
| Cancer Citations: | Search |
| Toxicology Citations: | Search |
| EPA Substance Registry Services (TSCA): | 464-48-2 |
| EPA ACToR: | Toxicology Data |
| EPA Substance Registry Services (SRS): | Registry |
| Laboratory Chemical Safety Summary : | 10050 |
| National Institute of Allergy and Infectious Diseases: | Data |
| WISER: | UN 2717 |
| WGK Germany: | 1 |
| (1S)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one | |
| Chemidplus: | 0000464482 |
| EPA/NOAA CAMEO: | hazardous materials |
| RTECS: | EX1250000 for cas# 464-48-2 |
References:
| Leffingwell: | Chirality or Article |
| (1S)-1,7,7-trimethylbicyclo[2.2.1]heptan-2-one | |
| NIST Chemistry WebBook: | Search Inchi |
| Pubchem (cid): | 10050 |
| Pubchem (sid): | 135269914 |
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 |
| KEGG (GenomeNet): | C00809 |
| HMDB (The Human Metabolome Database): | Search |
| Export Tariff Code: | 2914.21.2000 |
| VCF-Online: | VCF Volatile Compounds in Food |
| ChemSpider: | View |
| Wikipedia: | View |
Potential Blenders and core components note
Potential Uses:
Occurrence (nature, food, other): note
| armoise Search Trop Picture | |
| matricaria parthenium Search Trop Picture | |
| salvia grandiflora Search Trop Picture |
Synonyms:
| (-)- | alcanfor |
| bicyclo(2.2.1)heptan-2-one, 1,7,7-trimethyl-, (1S,4S)- | |
| bicyclo[2.2.1]heptan-2-one, 1,7,7-trimethyl-, (1S)- | |
| (-)- | bornan-2-one |
| (-)-2- | bornanone |
| (1S,4S)-(-)- | camphor |
| (1S)- | camphor |
| (1S)-(-)- | camphor |
| L- | camphor |
| laevo-(-)- | camphor |
| camphor, (1S,4S)-(-)- | |
| camphor, L-, (-)- | |
| (1S,4R)-(-)-1,3,3- | trimethyl bicyclo(2.2.1)heptan-2-one |
| (1S,4S)-1,7,7- | trimethyl bicyclo(2.2.1)heptan-2-one |
| (1S)-1,7,7- | trimethyl bicyclo(2.2.1)heptan-2-one |
| (1S)-1,7,7- | trimethylbicyclo[2.2.1]heptan-2-one |