1-(2-Chlorophenyl)ethanol

HCID 26082

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Basic information

CAS: 13524-04-4
Standard SMILES: CC(O)c1ccccc1Cl
InChIKey: DDUBOVLGCYUYFX-UHFFFAOYSA-N
Molecular formula: C8H9ClO
Average molar mass: 156.61 g/mol
Monoisotopic mass: 156.03419259

Names & identifiers

Preferred name: 1-(2-Chlorophenyl)ethanol
IUPAC: 1-(2-chlorophenyl)ethanol
English name: 1-(2-Chlorophenyl)-1-ethanol
Molecular formula: C8H9ClO
Molecular weight: 156.61

Names & synonyms

1-(2-CHLOROPHENYL)ETHANOL13524-04-4Benzenemethanol, 2-chloro-.alpha.-methyl-Benzenemethanol, 2-chloro-alpha-methyl-Benzyl alcohol, o-chloro-.alpha.-methyl-EINECS 236-868-4.alpha.-(o-Chlorophenyl)ethanolDDUBOVLGCYUYFX-UHFFFAOYSA-DTXSID80884623alpha-(o-Chlorophenyl)ethanolO-Chloro-alpha-methylbenzyl alcoholBenzyl alcohol, o-chloro-alpha-methyl-

Show more names

1-(2-chlorphenyl)ethanol1-(o-Chlorophenyl)ethanol2-Chlorophenyl methylcarbinolo-Chloro-α-methylbenzyl alcohol2-CHLORO-A-METHYLBENZYL ALCOHOL1-(2-CHLOROPHENYL)ETHANOL, 96%%

RefChem:74125DTXCID60835274DDUBOVLGCYUYFX-UHFFFAOYSA-NInChI=1/C8H9ClO/c1-6(10)7-4-2-3-5-8(7)9/h2-6,10H,1H31-(2-chlorophenyl)ethan-1-ol1-(2-Chlorophenyl)-1-ethanol2-Chloro-alpha-methylbenzyl alcoholMFCD00041037

Database identifiers

CAS: 13524-04-4
PubChem CID: 26082
DTXSID: DTXSID80884623
EC Number: 236-868-4
Nikkaji: J28.524B

Properties

Computed structural properties

XLogP: 2.1
Topological polar surface area: 20.2 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 1
Rotatable bonds: 1
Heavy atoms: 10
Formal charge: 0
Complexity: 105

Physicochemical properties

Boiling point: 121 · 121-123°C 14mm
Density: 1 · 1,18 g/cm3
Flash point: 121 · 121-123°C/14mm
refractive index: 1.545 · 1.5450
storage temp.: 2 · 2-8°C
form: clear liquid
pka: 14.05 · 14.05±0.20(Predicted)
color: Colorless to Light yellow
CAS DataBase Reference: 13524 · 13524-04-4(CAS DataBase Reference)
NIST Chemistry Reference: O-chloro-alpha-methylbenzyl alcohol(13524-04-4)
EPA Substance Registry System: 2 · Benzenemethanol, 2-chloro-.alpha.-methyl- (13524-04-4)
Symbol(GHS): 7 · GHS07
Signal word: Warning
Hazard statements: 302 · H302
Precautionary statements: 280 · P280-P305+P351+P338
Safety Statements: 24 · 24/25
TSCA: TSCA listed
HS Code: 29062990 · 29062990

Safety & regulation

GHS classification

GHS Classification · 4 items

Warning

H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.