chempirical

2-Chloro-1,4-dimethoxybenzene

C8H9ClO2CAS 2100-42-7172.61 g/mol

Open in Covalent MOL file
OOCl
Aryl halideEther

Properties

Molecular formula
C8H9ClO2
Molar mass
172.61 g/mol
Exact mass
172.0291 Da
Boiling point
124–126 °C
logP
2.36Crippen estimate
Polar surface area
18.5 Ų
H-bond donors / acceptors
0 / 2
Rotatable bonds
2

Identifiers

CAS number
2100-42-7
SMILES
COc1ccc(OC)c(Cl)c1
InChIKey
QMXZSRVFIWACJH-UHFFFAOYSA-N
InChI
InChI=1S/C8H9ClO2/c1-10-6-3-4-8(11-2)7(9)5-6/h3-5H,1-2H3

Weigh it out

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

Names and synonyms

9 names
  • Benzene, 2-chloro-1,4-dimethoxy-
  • Chlorohydroquinone dimethyl ether
  • 1-Chloro-2,5-dimethoxybenzene
  • Chloro-1,4-dimethoxybenzene
  • 2,5-Dimethoxychlorobenzene
  • Monochloro-1,4-dimethoxybenzene
  • NSC 60152
  • 2-Chloro-4-methoxyanisole
  • 2,5-Dimethoxyphenyl chloride

Work with 2-Chloro-1,4-dimethoxybenzene

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

1,2-Dichloro-4-methoxybenzene36404-30-569 % similar 1,2,4-Trimethoxybenzene135-77-362 % similar 2-Chloro-4-methoxyphenol18113-03-660 % similar 2-Chloro-1-fluoro-4-methoxybenzene202925-07-360 % similar 2-Chloro-4-fluoro-1-methoxybenzene2267-25-660 % similar 1,4-Dichloro-2,5-dimethoxybenzene2675-77-660 % similar 1-Bromo-2-chloro-4-methoxybenzene50638-46-560 % similar 3-Chloro-4-methoxyaniline5345-54-060 % 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-(4-Chlorophenoxy)ethanol1892-43-9 1-Chloro-3,5-dimethoxybenzene7051-16-3

Elsewhere

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