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849721-54-6 | Phosphorothioic acid, O-decyl ester
CAS No: 849721-54-6 Catalog No: AG004UJJ MDL No:
Product Description
Catalog Number:
AG004UJJ
Chemical Name:
Phosphorothioic acid, O-decyl ester
CAS Number:
849721-54-6
Molecular Formula:
C10H21O3PS--
Molecular Weight:
252.3107
IUPAC Name:
decoxy-dioxido-sulfanylidene-λ5-phosphane
InChI:
InChI=1S/C10H23O3PS/c1-2-3-4-5-6-7-8-9-10-13-14(11,12)15/h2-10H2,1H3,(H2,11,12,15)/p-2
InChI Key:
ISIPUCJUDOMIDU-UHFFFAOYSA-L
SMILES:
CCCCCCCCCCOP(=S)([O-])[O-]
Properties
Complexity:
182
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
252.095g/mol
Formal Charge:
-2
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
252.309g/mol
Monoisotopic Mass:
252.095g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
87.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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