Home Other Building Blocks Phosphorodithioic acid, O-ethyl S,S-dipropyl ester

Phosphorodithioic acid, O-ethyl S,S-dipropyl ester

CAS No.:
13194-48-4
Catalog Number:
AG000ZYK
Molecular Formula:
C8H19O2PS2
Molecular Weight:
242.3390
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Product Description
Catalog Number:
AG000ZYK
Chemical Name:
Phosphorodithioic acid, O-ethyl S,S-dipropyl ester
CAS Number:
13194-48-4
Molecular Formula:
C8H19O2PS2
Molecular Weight:
242.3390
MDL Number:
MFCD00055333
IUPAC Name:
1-[ethoxy(propylsulfanyl)phosphoryl]sulfanylpropane
InChI:
InChI=1S/C8H19O2PS2/c1-4-7-12-11(9,10-6-3)13-8-5-2/h4-8H2,1-3H3
InChI Key:
VJYFKVYYMZPMAB-UHFFFAOYSA-N
SMILES:
CCCSP(=O)(SCCC)OCC
EC Number:
236-152-1
UNII:
765Y5683OQ
RTECS Number:
TE4025000
UN Number:
3018
Properties
Complexity:
152  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
242.056g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
242.332g/mol
Monoisotopic Mass:
242.056g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
76.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6  
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