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16352-21-9 | 1,3,2-Dioxaphosphorinane, 2-oxide
CAS No: 16352-21-9 Catalog No: AG001U6D MDL No:
Product Description
Catalog Number:
AG001U6D
Chemical Name:
1,3,2-Dioxaphosphorinane, 2-oxide
CAS Number:
16352-21-9
Molecular Formula:
C3H7O3P
Molecular Weight:
122.0596
IUPAC Name:
1,3,2-dioxaphosphinan-2-ium 2-oxide
InChI:
InChI=1S/C3H6O3P/c4-7-5-2-1-3-6-7/h1-3H2/q+1
InChI Key:
ISLWZBTUAHMAND-UHFFFAOYSA-N
SMILES:
O=P1OCCCO1
Properties
Complexity:
74.2
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
121.005g/mol
Formal Charge:
1
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
121.052g/mol
Monoisotopic Mass:
121.005g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.1
Literature
| Title | Journal |
|---|---|
| CyDEPMPOs: a class of stable cyclic DEPMPO derivatives with improved properties as mechanistic markers of stereoselective hydroxyl radical adduct formation in biological systems. | Bioorganic & medicinal chemistry 20110401 |
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