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1235058-59-9 | 3-Pyrrolidinamine, N,N-dimethyl-1-(phenylmethyl)-, hydrochloride (1:2), (3R)-
CAS No: 1235058-59-9 Catalog No: AG000KP2 MDL No:MFCD11223480
Product Description
Catalog Number:
AG000KP2
Chemical Name:
3-Pyrrolidinamine, N,N-dimethyl-1-(phenylmethyl)-, hydrochloride (1:2), (3R)-
CAS Number:
1235058-59-9
Molecular Formula:
C13H22Cl2N2
Molecular Weight:
277.2332
MDL Number:
MFCD11223480
IUPAC Name:
(3R)-1-benzyl-N,N-dimethylpyrrolidin-3-amine;dihydrochloride
InChI:
InChI=1S/C13H20N2.2ClH/c1-14(2)13-8-9-15(11-13)10-12-6-4-3-5-7-12;;/h3-7,13H,8-11H2,1-2H3;2*1H/t13-;;/m1../s1
InChI Key:
QFYKJDHVUCCZDE-FFXKMJQXSA-N
SMILES:
CN([C@@H]1CCN(C1)Cc1ccccc1)C.Cl.Cl
Properties
Complexity:
185
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Exact Mass:
276.116g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
277.233g/mol
Monoisotopic Mass:
276.116g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
6.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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