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820984-23-4

820984-23-4 | 3-Pyrrolidinamine, N-[(4-methylphenyl)methyl]-N-(2-methylpropyl)-

CAS No: 820984-23-4 Catalog No: AG0051UV MDL No:

Product Description

Catalog Number:
AG0051UV
Chemical Name:
3-Pyrrolidinamine, N-[(4-methylphenyl)methyl]-N-(2-methylpropyl)-
CAS Number:
820984-23-4
Molecular Formula:
C16H26N2
Molecular Weight:
246.3910
IUPAC Name:
N-[(4-methylphenyl)methyl]-N-(2-methylpropyl)pyrrolidin-3-amine
InChI:
InChI=1S/C16H26N2/c1-13(2)11-18(16-8-9-17-10-16)12-15-6-4-14(3)5-7-15/h4-7,13,16-17H,8-12H2,1-3H3
InChI Key:
CFOIYFNTMYCTIE-UHFFFAOYSA-N
SMILES:
CC(CN(C1CNCC1)Cc1ccc(cc1)C)C

Properties

Complexity:
231  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.21g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
246.398g/mol
Monoisotopic Mass:
246.21g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
15.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.2  

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