2-Benzylidene-1-heptanol
2-Benzylidene-1-heptanol structure
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Common Name | 2-Benzylidene-1-heptanol | ||
|---|---|---|---|---|
| CAS Number | 101-85-9 | Molecular Weight | 204.308 | |
| Density | 1.0±0.1 g/cm3 | Boiling Point | 331.3±11.0 °C at 760 mmHg | |
| Molecular Formula | C14H20O | Melting Point | N/A | |
| MSDS | Chinese USA | Flash Point | 134.1±15.1 °C | |
| Symbol |
GHS07 |
Signal Word | Warning | |
This table lists Chinese names, IUPAC names and various aliases of this chemical substance.
| Name | 2-Benzylideneheptan-1-ol |
|---|---|
| Synonym | More Synonyms |
This table shows physicochemical parameters including melting point, boiling point, density, solubility and optical rotation. Missing data is marked as N/A.
| Density | 1.0±0.1 g/cm3 |
|---|---|
| Boiling Point | 331.3±11.0 °C at 760 mmHg |
| Molecular Formula | C14H20O |
| Molecular Weight | 204.308 |
| Flash Point | 134.1±15.1 °C |
| Exact Mass | 204.151413 |
| PSA | 20.23000 |
| LogP | 4.37 |
| Vapour Pressure | 0.0±0.8 mmHg at 25°C |
| Index of Refraction | 1.547 |
| InChIKey | LIPHCKNQPJXUQF-UHFFFAOYSA-N |
| SMILES | CCCCCC(=Cc1ccccc1)CO |
This table provides MSDS information including hazard classification, first‑aid, fire‑fighting, spill handling, operation and storage instructions.
This table summarizes toxicological test data, acute & chronic toxicity and ecological hazard parameters for this chemical.
CHEMICAL IDENTIFICATION
HEALTH HAZARD DATAACUTE TOXICITY DATA
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This table covers safety warnings, protective measures, incompatible substances and disposal guidelines for this compound.
| Symbol |
GHS07 |
|---|---|
| Signal Word | Warning |
| Hazard Statements | H319 |
| Precautionary Statements | P305 + P351 + P338 |
| Personal Protective Equipment | Eyeshields;full-face respirator (US);Gloves;multi-purpose combination respirator cartridge (US);type ABEK (EN14387) respirator filter |
| Hazard Codes | Xi: Irritant; |
| Risk Phrases | 36 |
| Safety Phrases | S26;S36 |
| RIDADR | NONH for all modes of transport |
| WGK Germany | 2 |
| RTECS | MJ3280000 |
| HS Code | 2906299090 |
This table presents publicly reported synthetic routes, reaction conditions, reactants and product information of the compound.
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~99%
2-Benzylidene-1... CAS#:101-85-9 |
| Literature: Shimizu, Hideo; Sayo, Noboru; Saito, Takao Synlett, 2009 , # 8 p. 1295 - 1298 |
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~%
2-Benzylidene-1... CAS#:101-85-9 |
| Literature: Annales de Chimie (Cachan, France), , vol. <11> 10, p. 281,360 Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences, , vol. 205, p. 802 |
This table lists upstream starting materials and downstream derivative products related to this chemical.
| Precursor 1 | |
|---|---|
| DownStream 0 | |
This table shows customs‑related data including HS‑code, tariff and regulatory conditions for import and export.
| HS Code | 2906299090 |
|---|---|
| Summary | 2906299090 other aromatic alcohols。Supervision conditions:None。VAT:17.0%。Tax rebate rate:9.0%。MFN tariff:5.5%。General tariff:30.0% |
This table lists relevant public references with title, journal and publication metadata for this compound.
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Sensitivity to alpha-amylcinnamic aldehyde and alpha-amylcinnamic alcohol.
J. Am. Acad. Dermatol. 8(1) , 76-80, (1983) Sensitivity to alpha-amylcinnamic aldehyde (alpha-AcAld) is apparently uncommon, but, like allergy to alpha-amylcinnamic alcohol (alpha-AcAlc), it often accompanies allergy to the perfume in Mycolog c... |
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Formaldehyde generators: relationship between stability, lipophilicity and carcinogenic potency.
Carcinogenesis 3(11) , 1273-6, (1982) The rate of hydrolysis to formaldehyde of methylenedimorpholine (MDM), hexamethylenetetramine (HMT) and dinitrosopentamethylenetetramine (DNPT) have been compared with the enzyme-mediated formation of... |
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Fragrance material review on alpha-amylcinnamyl alcohol.
Food Chem. Toxicol. 45 Suppl 1 , S32-9, (2007) A toxicologic and dermatologic review of alpha-amylcinnamyl alcohol when used as a fragrance ingredient is presented. |
This table collects all English aliases, systematic names and CAS‑related synonyms of the compound.
| 2-Benzylidene-1-heptanol |
| 2-Benzylideneheptan-1-ol |
| Amylcinnamyl alcohol |
| α-Amylcinnamyl alcohol |
| EINECS 202-982-8 |
| MFCD00022004 |
| alpha-Amylcinnamic alcohol |
This section contains frequently‑asked‑questions about this compound, including basic parameters, properties, storage conditions and corresponding answers.
| Q: What is the LogP of 2-Benzylideneheptan-1-ol? |
| A: LogP of 2-Benzylideneheptan-1-ol is 4.37. |
| Q: What is the polar surface area (PSA) of 2-Benzylideneheptan-1-ol? |
| A: Polar surface area (PSA) of 2-Benzylideneheptan-1-ol is 20.23000. |
| Q: What is the CAS number of 2-Benzylideneheptan-1-ol? |
| A: CAS number of 2-Benzylideneheptan-1-ol is 101-85-9. |
| Q: What are the upstream materials of 2-Benzylideneheptan-1-ol? |
| A: Related upstream materials(CAS) of 2-Benzylideneheptan-1-ol: 100-51-6. |
| Q: What is the molecular weight of 2-Benzylideneheptan-1-ol? |
| A: Molecular weight of 2-Benzylideneheptan-1-ol is 204.308. |
| Q: What is the safety information for 2-Benzylideneheptan-1-ol? |
| A: Safety information for 2-Benzylideneheptan-1-ol: S26;S36. |
| Q: What is the InChIKey of 2-Benzylideneheptan-1-ol? |
| A: InChIKey of 2-Benzylideneheptan-1-ol is LIPHCKNQPJXUQF-UHFFFAOYSA-N. |
| Q: What is the English name of 2-Benzylideneheptan-1-ol? |
| A: The English name of 2-Benzylideneheptan-1-ol is 2-Benzylideneheptan-1-ol. |
| Q: What is the molecular formula of 2-Benzylideneheptan-1-ol? |
| A: Molecular formula of 2-Benzylideneheptan-1-ol is C14H20O. |
| Q: What is the SMILES notation of 2-Benzylideneheptan-1-ol? |
| A: SMILES notation of 2-Benzylideneheptan-1-ol is CCCCCC(=Cc1ccccc1)CO. |
This table lists manufacturers and suppliers of this compound, including vendor names and product supply reference information.
| Shanghai Nianxing Industrial Co., Ltd |
| Dayang Chem (Hangzhou) Co., Ltd. |