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Home Other Building Blocks (1-benzyl-3-methylpiperidin-4-yl)methanamine, Mixture of diastereomers

(1-benzyl-3-methylpiperidin-4-yl)methanamine, Mixture of diastereomers

CAS No.:
2138430-68-7
Catalog Number:
AG01EJQ5
Molecular Formula:
C14H22N2
Molecular Weight:
218.3379
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Product Description
Catalog Number:
AG01EJQ5
Chemical Name:
(1-benzyl-3-methylpiperidin-4-yl)methanamine, Mixture of diastereomers
CAS Number:
2138430-68-7
Molecular Formula:
C14H22N2
Molecular Weight:
218.3379
MDL Number:
MFCD31421509
IUPAC Name:
(1-benzyl-3-methylpiperidin-4-yl)methanamine
InChI:
InChI=1S/C14H22N2/c1-12-10-16(8-7-14(12)9-15)11-13-5-3-2-4-6-13/h2-6,12,14H,7-11,15H2,1H3
InChI Key:
WMERLLDQCPOUQM-UHFFFAOYSA-N
SMILES:
NCC1CCN(CC1C)Cc1ccccc1
Properties
Complexity:
199  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
218.178g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
218.344g/mol
Monoisotopic Mass:
218.178g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
29.3A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties