Basic information
- CAS
25675-28-9- Standard SMILES
Cc1ccccc1C(C)O- InChIKey
SDCBYRLJYGORNK-UHFFFAOYSA-N- Molecular formula
- C9H12O
- Average molar mass
- 136.19 g/mol
- Monoisotopic mass
- 136.088815
Names & identifiers
- Preferred name
- 1-(2-Methylphenyl)ethanol
- IUPAC
- 1-(2-methylphenyl)ethanol
- English name
- 1-(2-Methylphenyl)ethanol
- Molecular formula
- C9H12O
- Molecular weight
- 136.19
Names & synonyms
1-(2-Methylphenyl)ethanol7287-82-3alpha-2-Dimethylbenzyl alcoholRefChem:1054025230-716-0o-Tolyl methylcarbinol1-(o-Tolyl)ethan-1-ol1-(2-methylphenyl)ethan-1-olMFCD00046632Methyl m-tolyl carbinol1-o-tolylethanolm-Tolyl methylcarbinol
Show more names
1-(2-Tolyl)ethanolO-TOLYLMETHYLCARBINOL1-(o-Methylphenyl)ethanolà,2-dimethylbenzyl alcohol2,α-Dimethylbenzyl alcoholα,2-Dimethylbenzyl alcohol
alpha,2-Dimethylbenzenemethanol2-tolylethanolBenzenemethanol, alpha,2-dimethyl-1-o-tolyl-ethanolEINECS 230-716-01-(o-tolyl)ethanolMethyl o-tolyl carbinolAI3-21992
Database identifiers
- CAS
25675-28-9、7287-82-3- PubChem CID
- 110953
- DTXSID
DTXSID60948555- EC Number
- 230-716-0
- Nikkaji
- J212.285E
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 20.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 101
Physicochemical properties
- Boiling point
- 78 · 78-80°C 2mm
- Density
- 0.995 · 0.995±0.06 g/cm3(Predicted)
- refractive index
- 1.5315 · 1.5315
- Flash point
- 78 · 78-80°C/2mm
- storage temp.
- Sealed in dry,Room Temperature
- pka
- 14.44 · 14.44±0.20(Predicted)
- Appearance
- Colorless to light yellow Liquid
- optical activity
- Consistent with structure
- BRN
- 2205145 · 2205145
- Henry's Law Constant
- 2.1 · 2.1×101 mol/(m3Pa) at 25℃, Wang et al. (2017)
- CAS DataBase Reference
- 7287 · 7287-82-3
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H319
- Precautionary statements
- 305 · P305+P351+P338
- Hazard Codes
- Xn
- Risk Statements
- 22 · 22-36
- Safety Statements
- 24 · 24/25
- WGK Germany
- 3 · 3
- HS Code
- 2906290090 · 2906290090
Safety & regulation
Safety data
- wgk
- 3
- hs_code
- 2906290090
- risk_code
- 22-36
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xn
- safety_code
- 24/25
- Hazard statements
- H302-H319
- Precautionary statements
- P305+P351+P338
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers57 total
上海康恩博医药科技有限公司17510465506 · [email protected]
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Related reactions
9 records
Compound notes
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