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1292289-46-3 | 2-Pyrrolidinone, 4-(aminomethyl)-, (4S)-
CAS No: 1292289-46-3 Catalog No: AG000YZA MDL No:MFCD23106120
Product Description
Catalog Number:
AG000YZA
Chemical Name:
2-Pyrrolidinone, 4-(aminomethyl)-, (4S)-
CAS Number:
1292289-46-3
Molecular Formula:
C5H10N2O
Molecular Weight:
114.1457
MDL Number:
MFCD23106120
IUPAC Name:
(4S)-4-(aminomethyl)pyrrolidin-2-one
InChI:
InChI=1S/C5H10N2O/c6-2-4-1-5(8)7-3-4/h4H,1-3,6H2,(H,7,8)/t4-/m0/s1
InChI Key:
TXFBWVRKVAEOPA-BYPYZUCNSA-N
SMILES:
NC[C@H]1CNC(=O)C1
Properties
Complexity:
103
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
114.079g/mol
Formal Charge:
0
Heavy Atom Count:
8
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
114.148g/mol
Monoisotopic Mass:
114.079g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
-1.4
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