Articles:
cyclohexene, 3-methyl-
Notes:
None found
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| CAS Number: | 591-48-0 |  3D/inchi
|
| Other(deleted CASRN): | 56688-75-6 | |
| ECHA EINECS - REACH Pre-Reg: | 209-717-5 | |
| FDA UNII: | 7X3KTM424G | |
| Nikkaji Web: | J132.795J | |
| MDL: | MFCD00001571 | |
| XlogP3-AA: | 2.80 (est) | |
| Molecular Weight: | 96.17264000 | |
| Formula: | C7 H12 | |
| NMR Predictor: | Predict (works with chrome, Edge or firefox) | |
Category: natural substances and extractives
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 |
Physical Properties:
| Appearance: | colorless clear liquid (est) |
| Assay: | 97.00 to 100.00 % |
| Food Chemicals Codex Listed: | No |
| Boiling Point: | 103.00 °C. @ 760.00 mm Hg |
| Vapor Pressure: | 35.974998 mmHg @ 25.00 °C. (est) |
| Flash Point: | 40.00 °F. TCC ( 4.44 °C. ) |
| logP (o/w): | 3.454 (est) |
| Shelf Life: | 24.00 month(s) or longer if stored properly. |
| Storage: | store in cool, dry place in tightly sealed containers, protected from heat and light. |
| Soluble in: | |
| alcohol | |
| water, 45.39 mg/L @ 25 °C (est) | |
Organoleptic Properties:
| Odor Description: at 10.00 % in dipropylene glycol. | citrus |
| Odor and/or flavor descriptions from others (if found). | |
Cosmetic Information:
| None found |
Suppliers:
| Santa Cruz Biotechnology |
| For experimental / research use only. |
| 3-Methyl-1-cyclohexene |
| TCI AMERICA |
| For experimental / research use only. |
| 3-Methyl-1-cyclohexene >93.0%(GC) |
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 | |
Safety in Use Information:
| Category: | natural substances and extractives | ||
| Recommendation for 3-methyl cyclohexene usage levels up to: | |||
| not for fragrance use. | |||
| Recommendation for 3-methyl cyclohexene flavor usage levels up to: | |||
| not for flavor use. | |||
Safety References:
| EPI System: | View |
| AIDS Citations: | Search |
| Cancer Citations: | Search |
| Toxicology Citations: | Search |
| EPA Substance Registry Services (TSCA): | 591-48-0 |
| EPA ACToR: | Toxicology Data |
| EPA Substance Registry Services (SRS): | Registry |
| Laboratory Chemical Safety Summary : | 11573 |
| National Institute of Allergy and Infectious Diseases: | Data |
| 3-methylcyclohexene | |
| Chemidplus: | 0000591480 |
References:
| 3-methylcyclohexene | |
| NIST Chemistry WebBook: | Search Inchi |
| Canada Domestic Sub. List: | 591-48-0 |
| Pubchem (cid): | 11573 |
| Pubchem (sid): | 134977270 |
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 |
| HMDB (The Human Metabolome Database): | Search |
| Export Tariff Code: | 2902.19.0050 |
| VCF-Online: | VCF Volatile Compounds in Food |
| ChemSpider: | View |
Potential Blenders and core components note
| None Found | ||
Potential Uses:
| abronia | FR | |
| ash mountain ash berry | FR | |
| bergamot | FR | |
| calamus oil replacer | FR | |
| cedrat | FR | |
| cilantro | FL/FR | |
| citronella | FR | |
| citrus | FR | |
| cologne | FR | |
| colonia | FR | |
| curacao | FR | |
| ginger | FR | |
| grapefruit | FR | |
| kumquat | FR | |
| lemon | FR | |
| lemongrass | FR | |
| lime | FR | |
| litsea cubeba | FL/FR | |
| mandarin | FR | |
| melissa oil replacer | FR | |
| mock orange | FR | |
| nectarine | FL | |
| orange | FR | |
| orange bitter orange | FL | |
| rhubarb | FR | |
| tangerine | FR | |
| verbena | FR |
Occurrence (nature, food, other): note
| found in nature |
Synonyms:
| cyclohexene, 3-methyl- | |
| 3- | methyl-1-cyclohexene |
| 3- | methylcyclohexene |