Home Other Building Blocks 4-methoxy-N-{[4-(propan-2-yl)phenyl]methyl}aniline

4-methoxy-N-{[4-(propan-2-yl)phenyl]methyl}aniline

CAS No.:
851269-50-6
Catalog Number:
AG019NU4
Molecular Formula:
C17H21NO
Molecular Weight:
255.3547
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Product Description
Catalog Number:
AG019NU4
Chemical Name:
4-methoxy-N-{[4-(propan-2-yl)phenyl]methyl}aniline
CAS Number:
851269-50-6
Molecular Formula:
C17H21NO
Molecular Weight:
255.3547
MDL Number:
MFCD04519881
IUPAC Name:
4-methoxy-N-[(4-propan-2-ylphenyl)methyl]aniline
InChI:
InChI=1S/C17H21NO/c1-13(2)15-6-4-14(5-7-15)12-18-16-8-10-17(19-3)11-9-16/h4-11,13,18H,12H2,1-3H3
InChI Key:
JWLRKARDJWMCKZ-UHFFFAOYSA-N
SMILES:
COc1ccc(cc1)NCc1ccc(cc1)C(C)C
Properties
Complexity:
238  
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:
5  
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5  
Properties