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114715-38-7 | 3-Pyrrolidinamine, 1-(phenylmethyl)-, (3S)-
CAS No: 114715-38-7 Catalog No: AG000F3R MDL No:MFCD00082766
Product Description
Catalog Number:
AG000F3R
Chemical Name:
3-Pyrrolidinamine, 1-(phenylmethyl)-, (3S)-
CAS Number:
114715-38-7
Molecular Formula:
C11H16N2
Molecular Weight:
176.2581
MDL Number:
MFCD00082766
IUPAC Name:
(3S)-1-benzylpyrrolidin-3-amine
InChI:
InChI=1S/C11H16N2/c12-11-6-7-13(9-11)8-10-4-2-1-3-5-10/h1-5,11H,6-9,12H2/t11-/m0/s1
InChI Key:
HBVNLKQGRZPGRP-NSHDSACASA-N
SMILES:
N[C@H]1CCN(C1)Cc1ccccc1
Properties
Complexity:
152
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
176.131g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
176.263g/mol
Monoisotopic Mass:
176.131g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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