2-(benzenesulfonyl)-4-methoxybenzaldehyde

2-(benzenesulfonyl)-4-methoxybenzaldehyde

CAS: 942474-72-8

Formula: C14H12O4S

SMILES: COC1=CC(=C(C=O)C=C1)S(=O)(=O)C1=CC=CC=C1

IUPAC: 2-(benzenesulfonyl)-4-methoxybenzaldehyde

InChI: InChI=1S/C14H12O4S/c1-18-12-8-7-11(10-15)14(9-12)19(16,17)13-5-3-2-4-6-13/h2-10H,1H3

Composition: C (60.86%), H (4.38%), O (23.16%), S (11.60%)

Molar Mass: 276.31

Atom Count: 31

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	276.04563004
Formal Charge	0
FSP3	0.07
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	DSTFHOSUPQRIEB-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	72.64
Topological Polar Surface Area	60.44
Polarizability	28.8
Ring Count	2
Rotatable Bond Count	4

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