4-methyl-1,3-thiazole-5-sulfonyl chloride

4-methyl-1,3-thiazole-5-sulfonyl chloride

CAS: 953070-51-4

Formula: C4H4ClNO2S2

SMILES: CC1=C(SC=N1)S(Cl)(=O)=O

IUPAC: 4-methyl-1,3-thiazole-5-sulfonyl chloride

InChI: InChI=1S/C4H4ClNO2S2/c1-3-4(9-2-6-3)10(5,7)8/h2H,1H3

Composition: C (24.31%), H (2.04%), Cl (17.94%), N (7.09%), O (16.19%), S (32.44%)

Molar Mass: 197.65

Atom Count: 14

Heavy Atom Count: 10

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	196.9371984
Formal Charge	0
FSP3	0.25
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	AWTJUYXVSWZCIK-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	39.21
Topological Polar Surface Area	47.03
Polarizability	16.18
Ring Count	1
Rotatable Bond Count	1

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