chempirical

Dimethylphenol

C8H10OCAS 1300-71-6122.17 g/mol

Open in Covalent MOL file
OH
Phenol

Properties

Molecular formula
C8H10O
Molar mass
122.17 g/mol
Exact mass
122.0732 Da
Density
1.02–1.03 g/mL (at 15 °C)
Melting point
20–76 °C
Boiling point
203–225 °C
logP
2.01Crippen estimate
Polar surface area
20.2 Ų
H-bond donors / acceptors
1 / 1
Rotatable bonds
0

Identifiers

CAS number
1300-71-6
SMILES
CC1=C(C(=CC=C1)O)C
InChIKey
QWBBPBRQALCEIZ-UHFFFAOYSA-N
InChI
InChI=1S/C8H10O/c1-6-4-3-5-8(9)7(6)2/h3-5,9H,1-2H3

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Names and synonyms

4 names
  • Phenol, dimethyl-
  • Xylenol
  • Sudol
  • 2,3-Dimethylphenol

Work with Dimethylphenol

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

2,3-Dimethylphenol526-75-0100 % similar 2-Methylresorcinol608-25-371 % similar O-Cresol95-48-761 % similar 3-Methylcatechol488-17-560 % similar 3-Chloro-2-methylphenol3260-87-558 % similar 3-Amino-2-methylphenol53222-92-758 % similar 2-Amino-3-methylphenol2835-97-456 % similar 3-Fluoro-2-methylphenol443-87-856 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

3-Methylanisole100-84-5 Ethyl phenyl ether103-73-1 4-Methylanisole104-93-8 2,4-Dimethylphenol105-67-9 3,5-Dimethylphenol108-68-9 4-Ethylphenol123-07-9 1-Phenylethanol13323-81-4 (S)-1-Phenylethanol1445-91-6

Elsewhere

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