2-bromo-1,3-thiazole-4-carbaldehyde

2-bromo-1,3-thiazole-4-carbaldehyde

CAS: 5198-80-1

Formula: C4H2BrNOS

SMILES: BrC1=NC(C=O)=CS1

IUPAC: 2-bromo-1,3-thiazole-4-carbaldehyde

InChI: InChI=1S/C4H2BrNOS/c5-4-6-3(1-7)2-8-4/h1-2H

Composition: C (25.02%), H (1.05%), Br (41.61%), N (7.29%), O (8.33%), S (16.70%)

Molar Mass: 192.03

Atom Count: 10

Heavy Atom Count: 8

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	190.904048
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	2
Hydrogen Bond Donor Count	0
InChIKey	MNQVIZWWCRPZOK-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	35.09
Topological Polar Surface Area	29.96
Polarizability	13.27
Ring Count	1
Rotatable Bond Count	1

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