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101253-50-3 | 6-Benzothiazolamine, 5-chloro-2-methyl-
CAS No: 101253-50-3 Catalog No: AG00042B MDL No:MFCD18826625
Product Description
Catalog Number:
AG00042B
Chemical Name:
6-Benzothiazolamine, 5-chloro-2-methyl-
CAS Number:
101253-50-3
Molecular Formula:
C8H7ClN2S
Molecular Weight:
198.6726
MDL Number:
MFCD18826625
IUPAC Name:
5-chloro-2-methyl-1,3-benzothiazol-6-amine
InChI:
InChI=1S/C8H7ClN2S/c1-4-11-7-2-5(9)6(10)3-8(7)12-4/h2-3H,10H2,1H3
InChI Key:
MOWJTBJTHSFSBO-UHFFFAOYSA-N
SMILES:
Cc1sc2c(n1)cc(c(c2)N)Cl
Properties
Complexity:
178
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
198.002g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
198.668g/mol
Monoisotopic Mass:
198.002g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
67.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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