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1558-60-7 | 2-Pyrrolidinone, 5-methyl-, (5S)-
CAS No: 1558-60-7 Catalog No: AG001O7M MDL No:
Product Description
Catalog Number:
AG001O7M
Chemical Name:
2-Pyrrolidinone, 5-methyl-, (5S)-
CAS Number:
1558-60-7
Molecular Formula:
C5H9NO
Molecular Weight:
99.1311
IUPAC Name:
(5S)-5-methylpyrrolidin-2-one
InChI:
InChI=1S/C5H9NO/c1-4-2-3-5(7)6-4/h4H,2-3H2,1H3,(H,6,7)/t4-/m0/s1
InChI Key:
YVIVRJLWYJGJTJ-BYPYZUCNSA-N
SMILES:
C[C@H]1CCC(=O)N1
Properties
Complexity:
90.1
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
99.068g/mol
Formal Charge:
0
Heavy Atom Count:
7
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
99.133g/mol
Monoisotopic Mass:
99.068g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
0
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