2-Phenylpropanol

HCID 447661
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Basic information

CAS
37778-99-7
Standard SMILES
C[C@H](CO)c1ccccc1
InChIKey
RNDNSYIPLPAXAZ-MRVPVSSYSA-N
Molecular formula
C9H12O
Average molar mass
136.19 g/mol
Monoisotopic mass
136.088815

Names & identifiers

Preferred name
2-Phenylpropanol
IUPAC
(2S)-2-phenylpropan-1-ol
English name
(S)-(-)-2-Phenyl-1-propanol
Molecular formula
C9H12O
Molecular weight
136.19

Names & synonyms

(2S)-2-phenylpropan-1-ol2-phenylpropanolRefChem:19634037778-99-7(S)-2-Phenylpropan-1-ol(S)-(-)-2-Phenyl-1-propanol(S)-2-Phenyl-1-propanol(-)-2-Phenyl-1-propanol(-)-2-PhenylpropanolMFCD001452492(S)-Phenyl-1-propanolS-(-)-2-Phenyl-1-propanol
Show more names
(S)-β-Methylbenzeneethanol(S)-2-phenyl propyl alcohol(s)-β-methylphenethyl alcohol[S,(-)]-β-Methylbenzeneethanol
2-Phenyl-1-propanol, (-)-2-Phenylpropyl alcohol, (-)-(S)-(-)-2-Phenylpropyl alcohol(S)-2-Phenylpropyl alcohol, (-)-Benzeneethanol, .beta.-methyl-, (S)-(S)-(-)-2-Phenyl-propanolW7Q89429ZO(2S)-2-phenyl-1-propanol

Database identifiers

CAS
37778-99-7
PubChem CID
447661
DTXSID
DTXSID401365845
UNII
W7Q89429ZO
EC Number
677-785-7
Nikkaji
J76.749B

Properties

Computed structural properties

XLogP
2.4
Topological polar surface area
20.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
1
Rotatable bonds
2
Heavy atoms
10

Physicochemical properties

Boiling point
214 °C · 214 °C(lit.)
Density
1 g/mL · 1 g/mL at 25 °C(lit.)
refractive index
20 · n20/D 1.526(lit.)
Flash point
108 °C · 108 °C
storage temp.
2 · 2-8°C
form
Liquid

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 4 reports by companies from 1 notifications to the ECHA C&L Inventory.

Safety data

PPE
Eyeshields, Gloves
wgk
3
hs_code
29062900
risk_code
22
Signal word
Warning
Symbol(GHS)
GHS07

Chemistry & industry

Applications

UsesFor synthesis of optically active products

Upstream & downstream products

Suppliers36 total

上海康恩博医药科技有限公司17510465506 · [email protected]
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
毕佳索（上海毕得医药科技股份有限公司）400-6005915 · [email protected]
上海腾准生物科技有限公司19821570922 · [email protected]
温州共赢化学有限公司+86-0086-577-64498589 +86-15355981851 · [email protected]

Related reactions

10 records
New reaction record

Compound notes

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