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152645-23-3 | 2(3H)-Oxazolone,3-(dimethylphosphinothioyl)-
CAS No: 152645-23-3 Catalog No: AG007JDR MDL No:
Product Description
Catalog Number:
AG007JDR
Chemical Name:
2(3H)-Oxazolone,3-(dimethylphosphinothioyl)-
CAS Number:
152645-23-3
Molecular Formula:
C5H8NO2PS
Molecular Weight:
177.1613
IUPAC Name:
3-dimethylphosphinothioyl-1,3-oxazol-2-one
InChI:
InChI=1S/C5H8NO2PS/c1-9(2,10)6-3-4-8-5(6)7/h3-4H,1-2H3
InChI Key:
HXJZCOTUNHUQCM-UHFFFAOYSA-N
SMILES:
O=c1occn1P(=S)(C)C
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
177.001g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
177.158g/mol
Monoisotopic Mass:
177.001g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
61.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
Literature
| Title | Journal |
|---|---|
| 3-Dimethylphosphinothioyl-2(3H)-oxazolone (MPTO), a promising new reagent for racemization-free couplings. | International journal of peptide and protein research 19930901 |
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