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17316-94-8 | Phosphonic acid, P-(2-ethoxyethenyl)-, dibutyl ester
CAS No: 17316-94-8 Catalog No: AG001YOT MDL No:
Product Description
Catalog Number:
AG001YOT
Chemical Name:
Phosphonic acid, P-(2-ethoxyethenyl)-, dibutyl ester
CAS Number:
17316-94-8
Molecular Formula:
C12H25O4P
Molecular Weight:
264.2983
IUPAC Name:
1-[butoxy(2-ethoxyethenyl)phosphoryl]oxybutane
InChI:
InChI=1S/C12H25O4P/c1-4-7-9-15-17(13,12-11-14-6-3)16-10-8-5-2/h11-12H,4-10H2,1-3H3
InChI Key:
UJEXGCIFLZEMRJ-UHFFFAOYSA-N
SMILES:
CCCCOP(=O)(C=COCC)OCCCC
Properties
Complexity:
227
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
264.149g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
264.302g/mol
Monoisotopic Mass:
264.149g/mol
Rotatable Bond Count:
11
Topological Polar Surface Area:
44.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.5
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