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17674-28-1 | Phosphonic acid, P-acetyl-, dimethyl ester
CAS No: 17674-28-1 Catalog No: AG0024VQ MDL No:
Product Description
Catalog Number:
AG0024VQ
Chemical Name:
Phosphonic acid, P-acetyl-, dimethyl ester
CAS Number:
17674-28-1
Molecular Formula:
C4H9O4P
Molecular Weight:
152.0856
IUPAC Name:
1-dimethoxyphosphorylethanone
InChI:
InChI=1S/C4H9O4P/c1-4(5)9(6,7-2)8-3/h1-3H3
InChI Key:
RJTQMWKXFLVXPU-UHFFFAOYSA-N
SMILES:
COP(=O)(C(=O)C)OC
Properties
Complexity:
145
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.024g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
152.086g/mol
Monoisotopic Mass:
152.024g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
52.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7
Literature
| Title | Journal |
|---|---|
| Glyoxylate carboligase: a unique thiamin diphosphate-dependent enzyme that can cycle between the 4'-aminopyrimidinium and 1',4'-iminopyrimidine tautomeric forms in the absence of the conserved glutamate. | Biochemistry 20121009 |
| Communication between thiamin cofactors in the Escherichia coli pyruvate dehydrogenase complex E1 component active centers: evidence for a 'direct pathway' between the 4'-aminopyrimidine N1' atoms. | The Journal of biological chemistry 20100409 |
| Direct kinetic evidence for half-of-the-sites reactivity in the E1 component of the human pyruvate dehydrogenase multienzyme complex through alternating sites cofactor activation. | Biochemistry 20061024 |
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