(benzenesulfonyl)methyl ethyl ethylphosphonate

(benzenesulfonyl)methyl ethyl ethylphosphonate

CAS: 56069-39-7

Formula: C11H17O5PS

SMILES: CCOP(=O)(CC)OCS(=O)(=O)C1=CC=CC=C1

IUPAC: (benzenesulfonyl)methyl ethyl ethylphosphonate

InChI: InChI=1/C11H17O5PS/c1-3-15-17(12,4-2)16-10-18(13,14)11-8-6-5-7-9-11/h5-9H,3-4,10H2,1-2H3

Composition: C (45.20%), H (5.86%), O (27.37%), P (10.60%), S (10.97%)

Molar Mass: 292.29

Atom Count: 35

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	292.053431819
Formal Charge	0
FSP3	0.45
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	0
InChIKey	PCXFNVBTOGRPIZ-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	68.6
Topological Polar Surface Area	69.67
Polarizability	28.43
Ring Count	1
Rotatable Bond Count	7

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