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2-chloro-4,7-difluoro-1,3-benzothiazole

2-chloro-4,7-difluoro-1,3-benzothiazole

CAS: 1177320-67-0

Formula: C7H2ClF2NS

SMILES: FC1=C2SC(Cl)=NC2=C(F)C=C1

IUPAC: 2-chloro-4,7-difluoro-1,3-benzothiazole

InChI: InChI=1S/C7H2ClF2NS/c8-7-11-5-3(9)1-2-4(10)6(5)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 YFFVYUGQFUQXNZ-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 42.59
Topological Polar Surface Area 12.89
Polarizability 17.12
Ring Count 2
Rotatable Bond Count 0

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