Home Other Building Blocks Benzeneethanamine, 4-methoxy-a-methyl-N-(phenylmethyl)-

Benzeneethanamine, 4-methoxy-a-methyl-N-(phenylmethyl)-

CAS No.:
43229-65-8
Catalog Number:
AG00I8B9
Molecular Formula:
C17H21NO
Molecular Weight:
255.3547
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Product Description
Catalog Number:
AG00I8B9
Chemical Name:
Benzeneethanamine, 4-methoxy-a-methyl-N-(phenylmethyl)-
CAS Number:
43229-65-8
Molecular Formula:
C17H21NO
Molecular Weight:
255.3547
MDL Number:
MFCD00025847
IUPAC Name:
N-benzyl-1-(4-methoxyphenyl)propan-2-amine
InChI:
InChI=1S/C17H21NO/c1-14(18-13-16-6-4-3-5-7-16)12-15-8-10-17(19-2)11-9-15/h3-11,14,18H,12-13H2,1-2H3
InChI Key:
CVGPWMGXKOKNFD-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)CC(NCc1ccccc1)C
EC Number:
256-155-1
Properties
Complexity:
229  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.162g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
255.361g/mol
Monoisotopic Mass:
255.162g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Properties