Phostex structure

Phostex

[(4-ethyl-3-methylhexan-3-yl)oxy-hydroperoxyphosphinothioyl] dihydrogen phosphate;[ethylperoxy(propan-2-yloxy)phosphinothioyl] dipropan-2-yl phosphate

Also Known As: Phostex|Niagara 1,137|BIO 1,137|Bis(dialkylphosphinothioyl) disulfides|KST-1A4796|ENT 23,584|[(1,2-diethyl-1-methyl-butoxy)-hydroperoxy-phosphinothioyl] dihydrogen phosphate;(ethylperoxy-isopropoxy-phosphinothioyl) diisopropyl phosphate|Disulfide, bis(diethylphosphinothioyl) mixed with disulfide, bis(diisopropylphosphinothioyl) (75%:25%)|Thioperoxydiphosphoric acid ([(HO)2P(S)]2S2), ethyl tris(1-methylethyl) ester, mixt. with thioperoxydiphosphoric acid ([(HO)2P(S)]2S2) triethyl 1-methylethyl ester|[(4-ethyl-3-methylhexan-3-yl)oxy-hydroperoxyphosphinothioyl] dihydrogen phosphate; [ethylperoxy(propan-2-yloxy)phosphinothioyl] dipropan-2-yl phosphate|Thioperoxydiphosphoric acid (((HO)2P(S))2S2), ethyl tris(1-methylethyl) ester, mixt. with thioperoxydiphosphoric acid (((HO)2P(S))2S2) triethyl 1-methylethyl ester

CAS: 42400-89-5
Molecular Formula C20H48O14P4S2
Molecular Weight 700.1436 g/mol
LogP 8.01
Topological Polar Surface Area 242.0 Ų
Hydrogen Bond Donors 3
Hydrogen Bond Acceptors 16
Rotatable Bonds 20
Exact Mass 700.1436
Monoisotopic Mass 700.1436
Heavy Atoms 40
Complexity 740.0

Chemical Identifiers

CAS Number 42400-89-5
SMILES CCC(CC)C(C)(CC)OP(=S)(OO)OP(=O)(O)O.CCOOP(=S)(OC(C)C)OP(=O)(OC(C)C)OC(C)C
InChIKey OZGWRVLDBXNOEG-UHFFFAOYSA-N

Product Overview

Phostex (CAS 42400-89-5), with molecular formula C20H48O14P4S2 and molecular weight 700.1436 g/mol. IUPAC: [(4-ethyl-3-methylhexan-3-yl)oxy-hydroperoxyphosphinothioyl] dihydrogen phosphate;[ethylperoxy(propan-2-yloxy)phosphinothioyl] dipropan-2-yl phosphate.

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