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155322-92-2 | 3-Pyrrolidinemethanamine, N,α-dimethyl-, (αS,3R)-
CAS No: 155322-92-2 Catalog No: AG001NTN MDL No:
Product Description
Catalog Number:
AG001NTN
Chemical Name:
3-Pyrrolidinemethanamine, N,α-dimethyl-, (αS,3R)-
CAS Number:
155322-92-2
Molecular Formula:
C7H16N2
Molecular Weight:
128.2153
IUPAC Name:
(3R)-3-[(1S)-1-(methylamino)ethyl]pyrrolidin-2-one
InChI:
InChI=1S/C7H14N2O/c1-5(8-2)6-3-4-9-7(6)10/h5-6,8H,3-4H2,1-2H3,(H,9,10)/t5-,6+/m0/s1
InChI Key:
QQNVPQIGPXWVKX-NTSWFWBYSA-N
SMILES:
CN[C@H]([C@H]1CNCC1)C
Properties
Complexity:
136
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Exact Mass:
142.111g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
142.202g/mol
Monoisotopic Mass:
142.111g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
41.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2
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