chempirical

2-Chloro-3-methylquinoline

C10H8ClNCAS 57876-69-4177.63 g/mol

Open in Covalent MOL file
NCl
Aryl halide

Properties

Molecular formula
C10H8ClN
Molar mass
177.63 g/mol
Exact mass
177.0345 Da
logP
3.20Crippen estimate
Polar surface area
12.9 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
0

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
57876-69-4
SMILES
CC1=CC2=CC=CC=C2N=C1Cl
InChIKey
UMYPPRQNLXTIEQ-UHFFFAOYSA-N
InChI
InChI=1S/C10H8ClN/c1-7-6-8-4-2-3-5-9(8)12-10(7)11/h2-6H,1H3

Weigh it out

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

Work with 2-Chloro-3-methylquinoline

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-Chloro-3-(chloromethyl)quinoline90097-52-254 % similar 2-Chloroquinoline-3-boronic acid128676-84-653 % similar 2-Chloro-3-quinolinecarboxaldehyde73568-25-953 % similar 2,3-Dichloroquinoxaline2213-63-050 % similar Acridine260-94-650 % similar 2-Chloro-3-quinolinecarboxylic acid73776-25-749 % similar 2,3-Dimethylnaphthalene581-40-846 % similar Acridine monohydrochloride17784-47-345 % similar

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

Same formula

4-Chloro-6-methylquinoline18436-71-0 4-Chloro-8-methylquinoline18436-73-2 8-Chloro-2-methylquinoline3033-82-7 4-Chloro-2-methylquinoline4295-06-1 2-Chloro-6-methylquinoline4295-11-8 5-Chloroquinaldine4964-69-6 7-Chloroquinaldine4965-33-7 1-(4-Chlorophenyl)-1H-pyrrole5044-38-2

Elsewhere

PubChem CAS Common Chemistry NIST WebBook