chempirical

2-Chloronaphthalene

C10H7ClCAS 91-58-7162.62 g/mol

Open in Covalent MOL file
Cl
Aryl halide

Properties

Molecular formula
C10H7Cl
Molar mass
162.62 g/mol
Exact mass
162.0236 Da
Melting point
59.5 °C
Boiling point
119.7 °C (at 11 Torr)
logP
3.49Crippen estimate
Polar surface area
0.0 Ų
H-bond donors / acceptors
0 / 0
Rotatable bonds
0

Identifiers

CAS number
91-58-7
SMILES
Clc1ccc2ccccc2c1
InChIKey
CGYGETOMCSJHJU-UHFFFAOYSA-N
InChI
InChI=1S/C10H7Cl/c11-10-6-5-8-3-1-2-4-9(8)7-10/h1-7H

Weigh it out

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

Names and synonyms

3 names
  • Naphthalene, 2-chloro-
  • β-Chloronaphthalene
  • PCN 2

Work with 2-Chloronaphthalene

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-Chloroanthracene17135-78-385 % similar 2-Fluoronaphthalene323-09-150 % similar 1,3-Dichlorobenzene541-73-150 % similar 6-Chloroquinoline612-57-750 % similar 7-Chloroquinoline612-61-350 % similar 2,2′-Binaphthalene612-78-250 % similar Anthracene120-12-747 % similar 6-Chloro-2-naphthalenesulfonyl chloride102153-63-947 % similar

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

Same formula

1-Chloronaphthalene90-13-1

Elsewhere

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