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1606-75-3 | Phosphonic acid, P-(2-oxoethyl)-, diethyl ester
CAS No: 1606-75-3 Catalog No: AG001S2B MDL No:MFCD00014673
Product Description
Catalog Number:
AG001S2B
Chemical Name:
Phosphonic acid, P-(2-oxoethyl)-, diethyl ester
CAS Number:
1606-75-3
Molecular Formula:
C6H13O4P
Molecular Weight:
180.1388
MDL Number:
MFCD00014673
IUPAC Name:
2-diethoxyphosphorylacetaldehyde
InChI:
InChI=1S/C6H13O4P/c1-3-9-11(8,6-5-7)10-4-2/h5H,3-4,6H2,1-2H3
InChI Key:
ZZWQVTBJLLXLPJ-UHFFFAOYSA-N
SMILES:
CCOP(=O)(CC=O)OCC
NSC Number:
377651
Properties
Complexity:
147
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.055g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
180.14g/mol
Monoisotopic Mass:
180.055g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.3
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