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20636-79-7 | 1,3,2-Dioxaphospholane, 2-hydroxy-4-methyl-, 2-oxide
CAS No: 20636-79-7 Catalog No: AG002IH1 MDL No:
Product Description
Catalog Number:
AG002IH1
Chemical Name:
1,3,2-Dioxaphospholane, 2-hydroxy-4-methyl-, 2-oxide
CAS Number:
20636-79-7
Molecular Formula:
C3H7O4P
Molecular Weight:
138.0590
IUPAC Name:
2-hydroxy-4-methyl-1,3,2λ5-dioxaphospholane 2-oxide
InChI:
InChI=1S/C3H7O4P/c1-3-2-6-8(4,5)7-3/h3H,2H2,1H3,(H,4,5)
InChI Key:
RYRDKOIZZRUCMC-UHFFFAOYSA-N
SMILES:
CC1COP(=O)(O1)O
Properties
Complexity:
133
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
138.008g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
138.059g/mol
Monoisotopic Mass:
138.008g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.8
Literature
| Title | Journal |
|---|---|
| Dinuclear Zn(II) complex promotes cleavage and isomerization of 2-hydroxypropyl alkyl phosphates by a common cyclic phosphate intermediate. | Journal of the American Chemical Society 20090325 |
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