5-chloro-6-methyl-1,3-benzothiazol-2-amine hydrochloride

5-chloro-6-methyl-1,3-benzothiazol-2-amine hydrochloride

CAS: 1559059-95-8

Formula: C8H8Cl2N2S

SMILES: Cl.CC1=C(Cl)C=C2N=C(N)SC2=C1

IUPAC: 5-chloro-6-methyl-1,3-benzothiazol-2-amine hydrochloride

InChI: InChI=1S/C8H7ClN2S.ClH/c1-4-2-7-6(3-5(4)9)11-8(10)12-7;/h2-3H,1H3,(H2,10,11);1H

Composition: C (40.87%), H (3.43%), Cl (30.15%), N (11.91%), S (13.64%)

Molar Mass: 235.13

Atom Count: 21

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	233.9785248
Formal Charge	0
FSP3	0.12
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	1
InChIKey	WNGWNECEKNWDBV-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	51.15
Topological Polar Surface Area	38.91
Polarizability	20.38
Ring Count	2
Rotatable Bond Count	0

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