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1289384-89-9 | 3-Pyrrolidinamine, N,N-bis[(4-methylphenyl)methyl]-, hydrochloride (1:1)
CAS No: 1289384-89-9 Catalog No: AG000YKR MDL No:
Product Description
Catalog Number:
AG000YKR
Chemical Name:
3-Pyrrolidinamine, N,N-bis[(4-methylphenyl)methyl]-, hydrochloride (1:1)
CAS Number:
1289384-89-9
Molecular Formula:
C20H27ClN2
Molecular Weight:
330.8948
IUPAC Name:
N,N-bis[(4-methylphenyl)methyl]pyrrolidin-3-amine;hydrochloride
InChI:
InChI=1S/C20H26N2.ClH/c1-16-3-7-18(8-4-16)14-22(20-11-12-21-13-20)15-19-9-5-17(2)6-10-19;/h3-10,20-21H,11-15H2,1-2H3;1H
InChI Key:
HYYZURORKNDAFC-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1)CN(C1CNCC1)Cc1ccc(cc1)C.Cl
Properties
Complexity:
290
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
330.186g/mol
Formal Charge:
0
Heavy Atom Count:
23
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
330.9g/mol
Monoisotopic Mass:
330.186g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
15.3A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
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