chempirical

5-Chloro-2-methylphenol

C7H7ClOCAS 5306-98-9142.58 g/mol

Open in Covalent MOL file
ClHO
Aryl halidePhenol

Properties

Molecular formula
C7H7ClO
Molar mass
142.58 g/mol
Exact mass
142.0185 Da
Melting point
73–74 °C
Boiling point
225 °C
logP
2.35Crippen estimate
Polar surface area
20.2 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
0

Identifiers

CAS number
5306-98-9
SMILES
Cc1ccc(Cl)cc1O
InChIKey
KKFPXGXMSBBNJI-UHFFFAOYSA-N
InChI
InChI=1S/C7H7ClO/c1-5-2-3-6(8)4-7(5)9/h2-4,9H,1H3

Weigh it out

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

Names and synonyms

7 names
  • Phenol, 5-chloro-2-methyl-
  • o-Cresol, 5-chloro-
  • 5-Chloro-o-cresol
  • 2-Methyl-5-chlorophenol
  • 3-Chloro-6-methylphenol
  • 4-Chloro-2-hydroxytoluene
  • NSC 157349

Work with 5-Chloro-2-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

4-Chlorocatechol2138-22-960 % similar 4-Chloro-1,2-dimethylbenzene615-60-160 % similar 4-Methylresorcinol496-73-156 % similar 2,5-Dichlorophenol583-78-856 % similar 2,4-Dichlorotoluene95-73-856 % similar 2,5-Dimethylphenol95-87-456 % similar 2-Bromo-5-chlorophenol13659-23-952 % similar 2-Bromo-4-chloro-1-methylbenzene27139-97-552 % 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 P-Chlorocresol59-50-7 3-Chloro-4-methylphenol615-62-3 2-Chloro-5-methylphenol615-74-7 4-Chloroanisole623-12-1

Elsewhere

PubChem CAS Common Chemistry NIST WebBook