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207602-29-7 | Pentanoic acid, 5-[[bis(diethoxyphosphinyl)methyl]amino]-5-oxo-
CAS No: 207602-29-7 Catalog No: AG002J60 MDL No:
Product Description
Catalog Number:
AG002J60
Chemical Name:
Pentanoic acid, 5-[[bis(diethoxyphosphinyl)methyl]amino]-5-oxo-
CAS Number:
207602-29-7
Molecular Formula:
C14H29NO9P2
Molecular Weight:
417.3289
IUPAC Name:
5-[bis(diethoxyphosphoryl)methylamino]-5-oxopentanoic acid
InChI:
InChI=1S/C14H29NO9P2/c1-5-21-25(19,22-6-2)14(26(20,23-7-3)24-8-4)15-12(16)10-9-11-13(17)18/h14H,5-11H2,1-4H3,(H,15,16)(H,17,18)
InChI Key:
HNDCFKGGRYYEBS-UHFFFAOYSA-N
SMILES:
CCOP(=O)(C(P(=O)(OCC)OCC)NC(=O)CCCC(=O)O)OCC
Properties
Complexity:
491
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
417.132g/mol
Formal Charge:
0
Heavy Atom Count:
26
Hydrogen Bond Acceptor Count:
9
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
417.332g/mol
Monoisotopic Mass:
417.132g/mol
Rotatable Bond Count:
15
Topological Polar Surface Area:
138A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.5
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