2-(benzenesulfonyl)-1,3-thiazole-5-carbaldehyde

2-(benzenesulfonyl)-1,3-thiazole-5-carbaldehyde

CAS: 477886-95-6

Formula: C10H7NO3S2

SMILES: O=CC1=CN=C(S1)S(=O)(=O)C1=CC=CC=C1

IUPAC: 2-(benzenesulfonyl)-1,3-thiazole-5-carbaldehyde

InChI: InChI=1S/C10H7NO3S2/c12-7-8-6-11-10(15-8)16(13,14)9-4-2-1-3-5-9/h1-7H

Composition: C (47.42%), H (2.79%), N (5.53%), O (18.95%), S (25.31%)

Molar Mass: 253.29

Atom Count: 23

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	252.986735437
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	ZFGXEJMYUKHQSN-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	60.64
Topological Polar Surface Area	64.1
Polarizability	24.18
Ring Count	2
Rotatable Bond Count	3

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90%	<2 Days	477886-95-6		$51.35-$524.40$51.35$63.37$86.31$524.40