2-chloro-4,6-difluoro-1,3-benzothiazole

2-chloro-4,6-difluoro-1,3-benzothiazole

CAS: 252681-57-5

Formula: C7H2ClF2NS

SMILES: FC1=CC(F)=C2N=C(Cl)SC2=C1

IUPAC: 2-chloro-4,6-difluoro-1,3-benzothiazole

InChI: InChI=1S/C7H2ClF2NS/c8-7-11-6-4(10)1-3(9)2-5(6)12-7/h1-2H

Composition: C (40.89%), H (0.98%), Cl (17.24%), F (18.48%), N (6.81%), S (15.59%)

Molar Mass: 205.61

Atom Count: 14

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	204.9564543
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	LZXONCQHRWRSKB-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	42.59
Topological Polar Surface Area	12.89
Polarizability	17.11
Ring Count	2
Rotatable Bond Count	0

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