2-(4-Chlorophenoxy)ethanol

C₈H₉ClO₂CAS 1892-43-9172.61 g/mol

Open in Covalent MOL file

Alcohol Aryl halide Ether

Properties

Molecular formula: C₈H₉ClO₂
Molar mass: 172.61 g/mol
Exact mass: 172.0291 Da
Melting point: 28 °C
Boiling point: 178 °C (at 35 Torr)
logP: 1.71Crippen estimate
Polar surface area: 29.5 Å²
H-bond donors / acceptors: 1 / 2
Rotatable bonds: 3

Hazards

Danger

H302 Harmful if swallowed88.6% of notifiers
H315 Causes skin irritation100% of notifiers
H318 Causes serious eye damage100% of notifiers
H335 May cause respiratory irritation97.7% of notifiers

Aggregated from 44 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+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number

1892-43-9

SMILES

OCCOc1ccc(Cl)cc1

InChIKey

GEGSSUSEWOHAFE-UHFFFAOYSA-N

InChI

InChI=1S/C8H9ClO2/c9-7-1-3-8(4-2-7)11-6-5-10/h1-4,10H,5-6H2

Weigh it out

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Names and synonyms

15 names · show all

Ethanol, 2-(4-chlorophenoxy)-
Ethanol, 2-(p-chlorophenoxy)-
2-(p-Chlorophenoxy)ethanol
Chloro-p-phenoxetol
p-Chlorophenyl monoglycol ether
p-Chlorophenyl glycol ether
Chlorophetanol
Fungisan
p-Chlorophenyl 2-hydroxyethyl ether
Mycotetracid
4-(2-Hydroxyethoxy)chlorobenzene
β-(p-Chlorophenoxy)ethanol
FKE 01
NSC 8133
2-(4-Chlorophenoxy)ethan-1-ol

Work with 2-(4-Chlorophenoxy)ethanol

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 Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Hydroquinone bis(2-hydroxyethyl) ether104-38-174 % similar 1-Chloro-4-(2-chloroethoxy)benzene13001-28-061 % similar Phenoxyethanol122-99-659 % similar 1-(2-Bromoethoxy)-4-chlorobenzene2033-76-359 % similar 2-(4-Bromophenoxy)ethanol34743-88-959 % similar Bis(p-chlorophenoxy)methane555-89-558 % similar 1,3-Bis(2-hydroxyethoxy)benzene102-40-957 % similar 1-Chloro-4-ethoxybenzene622-61-757 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

(1S)-1-(2-Chlorophenyl)ethane-1,2-diol133082-13-0 2-(2-Chlorophenoxy)ethanol15480-00-9 2-Chloro-1,4-dimethoxybenzene2100-42-7 1-Chloro-2,4-dimethoxybenzene7051-13-0 1-Chloro-3,5-dimethoxybenzene7051-16-3

Elsewhere

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