4-Chlorobenzeneethanol

C8H9ClOCAS 1875-88-3156.61 g/mol

Open in Covalent MOL file
HOCl
AlcoholAryl halide

Properties

Molecular formula
C8H9ClO
Molar mass
156.61 g/mol
Exact mass
156.0342 Da
Boiling point
259 °C
logP
1.87Crippen estimate
Polar surface area
20.2 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
2

Hazards

Warning
Irritant (GHS07)

Aggregated from 3 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
1875-88-3
SMILES
OCCc1ccc(Cl)cc1
InChIKey
HZFRKZWBVUJYDA-UHFFFAOYSA-N
InChI
InChI=1S/C8H9ClO/c9-8-3-1-7(2-4-8)5-6-10/h1-4,10H,5-6H2

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

11 names
  • Benzeneethanol, 4-chloro-
  • Phenethyl alcohol, p-chloro-
  • p-Chlorophenylethyl alcohol
  • p-Chlorophenethyl alcohol
  • 2-(p-Chlorophenyl)ethanol
  • 2-(4-Chlorophenyl)ethanol
  • 4-Chlorophenethyl alcohol
  • 2-(4-Chlorophenyl)-1-ethanol
  • NSC 404206
  • 4-Chlorophenethanol
  • p-Chlorophenethylic alcohol

Work with 4-Chlorobenzeneethanol

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Boiling point under vacuumAt any pressure, from its normal boiling point Isotope patternExact mass and the mass spectrum pattern

Similar compounds

4-Chlorobenzenepropanol6282-88-874 % similar 2-(3-Chlorophenyl)ethanol5182-44-562 % similar 4-Chlorobenzyl alcohol873-76-761 % similar 2-(3,4-Dichlorophenyl)ethanol35364-79-556 % similar Tyrosol501-94-054 % similar Phenethyl alcohol60-12-852 % similar 2-(4-Aminophenyl)ethanol104-10-952 % similar 2-(4-Chlorophenyl)ethylamine156-41-252 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

4-Chloro-2,6-dimethylphenol1123-63-3 (1R)-1-(3-Chlorophenyl)ethanol120121-01-9 (1R)-1-(2-Chlorophenyl)ethan-1-ol120466-66-2 (S)-1-(2-Chlorophenyl)ethanol131864-71-6 1-Chloro-4-methoxy-2-methylbenzene13334-71-9 (1S)-1-(3-Chlorophenyl)ethan-1-ol135145-34-5 1-(2-Chlorophenyl)ethanol13524-04-4 4-Chloro-3-ethylphenol14143-32-9

Elsewhere

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