chempirical

2-Amino-6-chlorobenzothiazole

C7H5ClN2SCAS 95-24-9184.64 g/mol

Open in Covalent MOL file
HNHNClS
Aryl halide

Properties

Molecular formula
C7H5ClN2S
Molar mass
184.64 g/mol
Exact mass
183.9862 Da
Melting point
198 °C
logP
2.36Crippen estimate
Polar surface area
39.6 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
0

Identifiers

CAS number
95-24-9
SMILES
N=c1[nH]c2ccc(Cl)cc2s1
InChIKey
VMNXKIDUTPOHPO-UHFFFAOYSA-N
InChI
InChI=1S/C7H5ClN2S/c8-4-1-2-5-6(3-4)11-7(9)10-5/h1-3H,(H2,9,10)

Weigh it out

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

Names and synonyms

10 names
  • 2-Benzothiazolamine, 6-chloro-
  • Benzothiazole, 2-amino-6-chloro-
  • 6-Chloro-2-benzothiazolamine
  • 6-Chloro-2-benzothiazolylamine
  • 6-Chloro-1,3-benzothiazol-2-ylamine
  • 6-Chloro-2-aminobenzothiazole
  • 6-Chloro-1,3-benzothiazol-2-amine
  • SKA 3
  • 6-Chlorobenzo[d]thiazol-2-amine
  • 2-Amino-6-chloro-1,3-benzothiazole

Work with 2-Amino-6-chlorobenzothiazole

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-Amino-6-bromobenzothiazole15864-32-158 % similar 2-Amino-6-benzothiazolol26278-79-558 % similar 2-Amino-6-fluorobenzothiazole348-40-358 % similar 2-Amino-5,6-dichlorobenzothiazole24072-75-156 % similar 2-Amino-6-methoxybenzothiazole1747-60-053 % similar 2-Aminobenzothiazole136-95-852 % similar Riluzole1744-22-549 % similar 6-(Methylsulfonyl)-2-benzothiazolamine17557-67-449 % similar

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

Same formula

4-Chloro-6-methylthieno(2,3-d)pyrimidine106691-21-8 2-Amino-4-chlorobenzothiazole19952-47-7 5-Chloro-2-benzothiazolamine20358-00-3 5-Chloro-2-mercaptobenzimidazole25369-78-2 4-Chloro-5-methylthieno[2,3-D]pyrimidine43088-67-1

Elsewhere

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