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132166-79-1 | L-Proline, 5-oxo-, chloromethyl ester
CAS No: 132166-79-1 Catalog No: AG0010BQ MDL No:
Product Description
Catalog Number:
AG0010BQ
Chemical Name:
L-Proline, 5-oxo-, chloromethyl ester
CAS Number:
132166-79-1
Molecular Formula:
C6H8ClNO3
Molecular Weight:
177.5856
IUPAC Name:
chloromethyl (2S)-5-oxopyrrolidine-2-carboxylate
InChI:
InChI=1S/C6H8ClNO3/c7-3-11-6(10)4-1-2-5(9)8-4/h4H,1-3H2,(H,8,9)/t4-/m0/s1
InChI Key:
ITOHCVZZXXACBT-BYPYZUCNSA-N
SMILES:
ClCOC(=O)[C@@H]1CCC(=O)N1
Properties
Complexity:
183
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
177.019g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
177.584g/mol
Monoisotopic Mass:
177.019g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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