4-(1,3-benzothiazol-2-yl)benzoyl chloride

4-(1,3-benzothiazol-2-yl)benzoyl chloride

CAS: 2182-79-8

Formula: C14H8ClNOS

SMILES: ClC(=O)C1=CC=C(C=C1)C1=NC2=CC=CC=C2S1

IUPAC: 4-(1,3-benzothiazol-2-yl)benzoyl chloride

InChI: InChI=1S/C14H8ClNOS/c15-13(17)9-5-7-10(8-6-9)14-16-11-3-1-2-4-12(11)18-14/h1-8H

Composition: C (61.43%), H (2.95%), Cl (12.95%), N (5.12%), O (5.84%), S (11.71%)

Molar Mass: 273.73

Atom Count: 26

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	273.0015128
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	JPCXZSYVPLLPBD-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	83.35
Topological Polar Surface Area	29.96
Polarizability	29.64
Ring Count	3
Rotatable Bond Count	2

Suppliers

MATRIX SCIENTIFIC

Supplier Profile

Purity	LeadTime	CAS		UnitPrice
95%	<2 Days	2182-79-8		Quote Only