2,6-Dichlorobenzeneethanol

C8H8Cl2OCAS 30595-79-0191.05 g/mol

Open in Covalent MOL file
HOClCl
AlcoholAryl halide

Properties

Molecular formula
C8H8Cl2O
Molar mass
191.05 g/mol
Exact mass
189.9952 Da
logP
2.53Crippen estimate
Polar surface area
20.2 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
2

Hazards

Warning
Irritant (GHS07)

Aggregated from 2 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

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

Identifiers

CAS number
30595-79-0
SMILES
OCCc1c(Cl)cccc1Cl
InChIKey
ZBQPKQUIKJDGIX-UHFFFAOYSA-N
InChI
InChI=1S/C8H8Cl2O/c9-7-2-1-3-8(10)6(7)4-5-11/h1-3,11H,4-5H2

Weigh it out

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

Names and synonyms

6 names
  • Benzeneethanol, 2,6-dichloro-
  • Phenethyl alcohol, 2,6-dichloro-
  • 2,6-Dichlorophenethanol
  • 2-(2,6-Dichlorophenyl)ethanol
  • 2,6-Dichlorophenethyl alcohol
  • 2-(2,6-Dichlorophenyl)ethan-1-ol

Work with 2,6-Dichlorobenzeneethanol

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

2-(2-Chloro-6-fluorophenyl)ethanol214262-86-970 % similar 2-Chlorobenzeneethanol19819-95-562 % similar 2,6-Dichlorobenzyl alcohol15258-73-858 % similar 2-[(2,6-Dichlorobenzyl)oxy]ethanol85309-91-755 % similar 2,6-Dichlorophenethylamine14573-23-054 % similar 2-(3-Chlorophenyl)ethanol5182-44-548 % similar 2,6-Dichlorobenzyl chloride2014-83-748 % similar 4-Chlorotryptophol41340-30-147 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

1-Chloro-4-(2-chloroethoxy)benzene13001-28-0 2,4-Dichloro-3,5-dimethylphenol133-53-9 1,3-Dichloro-2-(methoxymethyl)benzene33486-90-7 2-(3,4-Dichlorophenyl)ethanol35364-79-5 2,6-Dichloro-α-methylbenzenemethanol53066-19-6 2,4-Dichlorophenethyl alcohol81156-68-5

Elsewhere

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