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89197-83-1 | Butanoic acid, 4-[(dibutoxyphosphinyl)oxy]-
CAS No: 89197-83-1 Catalog No: AG003VPC MDL No:
Product Description
Catalog Number:
AG003VPC
Chemical Name:
Butanoic acid, 4-[(dibutoxyphosphinyl)oxy]-
CAS Number:
89197-83-1
Molecular Formula:
C12H25O6P
Molecular Weight:
296.2971
IUPAC Name:
4-dibutoxyphosphoryloxybutanoic acid
InChI:
InChI=1S/C12H25O6P/c1-3-5-9-16-19(15,17-10-6-4-2)18-11-7-8-12(13)14/h3-11H2,1-2H3,(H,13,14)
InChI Key:
LSLSIIGLFRKEKX-UHFFFAOYSA-N
SMILES:
CCCCOP(=O)(OCCCC)OCCCC(=O)O
Properties
Complexity:
267
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.139g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
6
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
296.3g/mol
Monoisotopic Mass:
296.139g/mol
Rotatable Bond Count:
13
Topological Polar Surface Area:
82.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.9
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