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808172-50-1 | 2-Pyrrolidinone, 5-(2-hydroxyethyl)-, (5S)-
CAS No: 808172-50-1 Catalog No: AG005IP6 MDL No:MFCD19217591
Product Description
Catalog Number:
AG005IP6
Chemical Name:
2-Pyrrolidinone, 5-(2-hydroxyethyl)-, (5S)-
CAS Number:
808172-50-1
Molecular Formula:
C6H11NO2
Molecular Weight:
129.1570
MDL Number:
MFCD19217591
IUPAC Name:
(5S)-5-(2-hydroxyethyl)pyrrolidin-2-one
InChI:
InChI=1S/C6H11NO2/c8-4-3-5-1-2-6(9)7-5/h5,8H,1-4H2,(H,7,9)/t5-/m0/s1
InChI Key:
GPVDPHDTYDBCAI-YFKPBYRVSA-N
SMILES:
OCC[C@@H]1CCC(=O)N1
Properties
Complexity:
114
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
129.079g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
129.159g/mol
Monoisotopic Mass:
129.079g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
49.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.7
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