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229323-07-3 | 3-Pyrrolidinemethanamine, 1-(phenylmethyl)-, (3S)-
CAS No: 229323-07-3 Catalog No: AG002LJV MDL No:MFCD07369980
Product Description
Catalog Number:
AG002LJV
Chemical Name:
3-Pyrrolidinemethanamine, 1-(phenylmethyl)-, (3S)-
CAS Number:
229323-07-3
Molecular Formula:
C12H18N2
Molecular Weight:
190.2847
MDL Number:
MFCD07369980
IUPAC Name:
[(3S)-1-benzylpyrrolidin-3-yl]methanamine
InChI:
InChI=1S/C12H18N2/c13-8-12-6-7-14(10-12)9-11-4-2-1-3-5-11/h1-5,12H,6-10,13H2/t12-/m0/s1
InChI Key:
SUAKIVNGQVUKJA-LBPRGKRZSA-N
SMILES:
NC[C@@H]1CCN(C1)Cc1ccccc1
Properties
Complexity:
164
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
190.147g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
190.29g/mol
Monoisotopic Mass:
190.147g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
29.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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