Home Other Building Blocks N-benzyl-3,4-dimethoxyaniline

N-benzyl-3,4-dimethoxyaniline

CAS No.:
39217-14-6
Catalog Number:
AG019LUR
Molecular Formula:
C15H17NO2
Molecular Weight:
243.3010
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Product Description
Catalog Number:
AG019LUR
Chemical Name:
N-benzyl-3,4-dimethoxyaniline
CAS Number:
39217-14-6
Molecular Formula:
C15H17NO2
Molecular Weight:
243.3010
MDL Number:
MFCD01564501
IUPAC Name:
N-benzyl-3,4-dimethoxyaniline
InChI:
InChI=1S/C15H17NO2/c1-17-14-9-8-13(10-15(14)18-2)16-11-12-6-4-3-5-7-12/h3-10,16H,11H2,1-2H3
InChI Key:
ISFAKKYTEKYAMC-UHFFFAOYSA-N
SMILES:
COc1cc(NCc2ccccc2)ccc1OC
Properties
Complexity:
229  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.126g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
243.306g/mol
Monoisotopic Mass:
243.126g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
30.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3  
Properties