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84858-81-1 | Acetic acid, (butylethoxyphosphinyl)-, ethyl ester
CAS No: 84858-81-1 Catalog No: AG004MML MDL No:
Product Description
Catalog Number:
AG004MML
Chemical Name:
Acetic acid, (butylethoxyphosphinyl)-, ethyl ester
CAS Number:
84858-81-1
Molecular Formula:
C10H21O4P
Molecular Weight:
236.2451
IUPAC Name:
ethyl 2-[butyl(ethoxy)phosphoryl]acetate
InChI:
InChI=1S/C10H21O4P/c1-4-7-8-15(12,14-6-3)9-10(11)13-5-2/h4-9H2,1-3H3
InChI Key:
GUVIBKLUJWOFRR-UHFFFAOYSA-N
SMILES:
CCCCP(=O)(CC(=O)OCC)OCC
Properties
Complexity:
228
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
236.118g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
236.248g/mol
Monoisotopic Mass:
236.118g/mol
Rotatable Bond Count:
9
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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