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117286-92-7 | L-Proline, 1-[bis(1-methylethoxy)phosphinyl]-4-hydroxy-, (4R)-
CAS No: 117286-92-7 Catalog No: AG000E1P MDL No:MFCD22666120
Product Description
Catalog Number:
AG000E1P
Chemical Name:
L-Proline, 1-[bis(1-methylethoxy)phosphinyl]-4-hydroxy-, (4R)-
CAS Number:
117286-92-7
Molecular Formula:
C11H22NO6P
Molecular Weight:
295.2692
MDL Number:
MFCD22666120
IUPAC Name:
(2S,4R)-1-di(propan-2-yloxy)phosphoryl-4-hydroxypyrrolidine-2-carboxylic acid
InChI:
InChI=1S/C11H22NO6P/c1-7(2)17-19(16,18-8(3)4)12-6-9(13)5-10(12)11(14)15/h7-10,13H,5-6H2,1-4H3,(H,14,15)/t9-,10+/m1/s1
InChI Key:
GDXYIXOXIZJSET-ZJUUUORDSA-N
SMILES:
O[C@@H]1C[C@H](N(C1)P(=O)(OC(C)C)OC(C)C)C(=O)O
EC Number:
601-470-5
Properties
Complexity:
358
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
295.118g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
295.272g/mol
Monoisotopic Mass:
295.118g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
96.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
Literature
| Title | Journal |
|---|---|
| Efficient one-pot synthesis of the 2-aminocarbonylpyrrolidin-4-ylthio-containing side chain of the new broad-spectrum carbapenem antibiotic ertapenem. | The Journal of organic chemistry 20020712 |
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