2-bromo-5-phenyl-1,3-thiazole

2-bromo-5-phenyl-1,3-thiazole

CAS: 133311-51-0

Formula: C9H6BrNS

SMILES: BrC1=NC=C(S1)C1=CC=CC=C1

IUPAC: 2-bromo-5-phenyl-1,3-thiazole

InChI: InChI=1S/C9H6BrNS/c10-9-11-6-8(12-9)7-4-2-1-3-5-7/h1-6H

Composition: C (45.02%), H (2.52%), Br (33.28%), N (5.83%), S (13.35%)

Molar Mass: 240.12

Atom Count: 18

Heavy Atom Count: 12

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	238.940433
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	1
Hydrogen Bond Donor Count	0
InChIKey	DQKKZVBNEAECJZ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	53.81
Topological Polar Surface Area	12.89
Polarizability	21.87
Ring Count	2
Rotatable Bond Count	1

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