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Basic information
- CAS
56836-93-2- Standard SMILES
CC(O)C(C)Cc1ccccc1- InChIKey
VSIXJPFQJMODCS-UHFFFAOYSA-N- Molecular formula
- C11H16O
- Average molar mass
- 164.248 g/mol
- Monoisotopic mass
- 164.12011513
Names & identifiers
- Preferred name
- 3-Methyl-4-phenyl-2-butanol
- IUPAC
- 3-Methyl-4-phenylbutan-2-ol
- English name
- 3-methyl-4-phenylbutan-2-ol
- Molecular formula
- C11H16O
- Molecular weight
- 164.24
Names & synonyms
Ai3-24792muguet butanolEinecs 260-398-93-Methyl-4-phenyl-2-butanol3-methyl-4-phenylbutan-2-ol3-Methyl-4-phenylbutane-2-olBenzenepropanol, α,β-dimethyl-α,β-Dimethylbenzene-1-propanolalpha,beta-DimethylbenzenepropanolBenzenepropanol, alpha,beta-dimethyl-
Database identifiers
- CAS
56836-93-2- PubChem CID
- 92543
- DTXSID
DTXSID8052229- EC Number
- 260-398-9
- Nikkaji
- J267.113A
Properties
Physicochemical properties
- Boiling point
- 245.5 ℃[at · 245.5℃[at 101 325 Pa]
- Density
- 0.972 · 0.972[at 20℃]
- vapor pressure
- 1.1 Pa · 1.1Pa at 24℃
- pka
- 15.1 · 15.10±0.20(Predicted)
- Odor
- 100 % · at 100.00 %. floral muguet green rose mentholic
- Odor Type
- floral
- Water Solubility
- 3.3 g/L · 3.3g/L at 24℃
- LogP
- 3.1 at · 3.1 at 25℃
- EWG's Food Scores
- 1 · 1
- EPA Substance Registry System
- Benzenepropanol, .alpha.,.beta.-dimethyl- (56836-93-2)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 412 · H412-H319
- Precautionary statements
- 264 · P264-P280-P305+P351+P338-P337+P313P-P273-P501
- TSCA
- TSCA listed
- REACH Registrations
- Active
Safety & regulation
Safety data
- tsca
- TSCA listed
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H412-H319
- REACH Registrations
- Active
- Precautionary statements
- P264-P280-P305+P351+P338-P337+P313P-P273-P501
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Suppliers8 total
南京世洲生物科技有限公司025-025-85560043 17301488900 · [email protected]
梯希爱（上海）化工贸易有限公司021-61109150 · [email protected]
武汉柔博医药化工有限公司027-027-87827088 18986164924 · [email protected]
天津丹骏国际贸易有限公司15822601686 · [email protected]
XIAMEN AMITY INDUSTRY AND TRADE CO., LTD.+8618950047208 · [email protected]
湖北美索伦科技有限公司13419562052 13419562052 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
南京世洲生物科技有限公司025-85560043 13675144456 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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