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136496-88-3 | Butanoic acid, 4,4-bis(diethoxyphosphinyl)-
CAS No: 136496-88-3 Catalog No: AG0011WX MDL No:MFCD16877720
Product Description
Catalog Number:
AG0011WX
Chemical Name:
Butanoic acid, 4,4-bis(diethoxyphosphinyl)-
CAS Number:
136496-88-3
Molecular Formula:
C12H26O8P2
Molecular Weight:
360.2776
MDL Number:
MFCD16877720
IUPAC Name:
4,4-bis(diethoxyphosphoryl)butanoic acid
InChI:
InChI=1S/C12H26O8P2/c1-5-17-21(15,18-6-2)12(10-9-11(13)14)22(16,19-7-3)20-8-4/h12H,5-10H2,1-4H3,(H,13,14)
InChI Key:
KBFLOZIKDSCHEB-UHFFFAOYSA-N
SMILES:
CCOP(=O)(C(P(=O)(OCC)OCC)CCC(=O)O)OCC
Properties
Complexity:
375
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
360.11g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
360.28g/mol
Monoisotopic Mass:
360.11g/mol
Rotatable Bond Count:
13
Topological Polar Surface Area:
108A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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