2-Chloro-5-methylphenol

C₇H₇ClOCAS 615-74-7142.58 g/mol

Open in Covalent MOL file

Aryl halide Phenol

Properties

Molecular formula: C₇H₇ClO
Molar mass: 142.58 g/mol
Exact mass: 142.0185 Da
Density: 1.22 g/mL
Melting point: 45.5 °C
Boiling point: 196 °C
logP: 2.35Crippen estimate
Polar surface area: 20.2 Å²
H-bond donors / acceptors: 1 / 1
Rotatable bonds: 0

Hazards

Danger

H302 Harmful if swallowed51.2% of notifiers
H312 Harmful in contact with skin50% of notifiers
H315 Causes skin irritation56% of notifiers
H317 May cause an allergic skin reaction44% of notifiers
H318 Causes serious eye damage48.8% of notifiers
H319 Causes serious eye irritation47.6% of notifiers
H335 May cause respiratory irritation51.2% of notifiers
H400 Very toxic to aquatic life48.8% of notifiers

Aggregated from 84 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P270, P271, P272, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P305+P354+P338, P317, P319, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, P391, P403+P233, P405, P501

Identifiers

CAS number

615-74-7

SMILES

Cc1ccc(Cl)c(O)c1

InChIKey

SMFHPCZZAAMJJO-UHFFFAOYSA-N

InChI

InChI=1S/C7H7ClO/c1-5-2-3-6(8)7(9)4-5/h2-4,9H,1H3

Weigh it out

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

Names and synonyms

8 names

Phenol, 2-chloro-5-methyl-
m-Cresol, 6-chloro-
6-Chloro-m-cresol
3-Methyl-6-chlorophenol
5-Methyl-2-chlorophenol
6-Chloro-3-methylphenol
4-Chloro-3-hydroxytoluene
1-Chloro-2-hydroxy-4-methylbenzene

Work with 2-Chloro-5-methylphenol

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

2-Chloro-4-methylphenol6640-27-372 % similar 3,4-Dichlorotoluene95-75-063 % similar 4-Methylcatechol452-86-860 % similar 5-Amino-2-chlorophenol6358-06-157 % similar 2,5-Dichlorophenol583-78-856 % similar 4-Chloro-M-xylene95-66-956 % similar 2,5-Dimethylphenol95-87-456 % similar 4-Chlororesorcinol95-88-556 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

4-Chloro-2-methylphenol1570-64-5 2-Chlorobenzyl alcohol17849-38-6 3-Chloroanisole2845-89-8 3-Chloro-2-methylphenol3260-87-5 5-Chloro-2-methylphenol5306-98-9 P-Chlorocresol59-50-7 3-Chloro-4-methylphenol615-62-3 4-Chloroanisole623-12-1

Elsewhere

PubChem CAS Common Chemistry NIST WebBook