Home Other Building Blocks N-ethyl-4-methoxyaniline

N-ethyl-4-methoxyaniline

CAS No.:
104-48-3
Catalog Number:
AG019LWI
Molecular Formula:
C9H13NO
Molecular Weight:
151.2056
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Product Description
Catalog Number:
AG019LWI
Chemical Name:
N-ethyl-4-methoxyaniline
CAS Number:
104-48-3
Molecular Formula:
C9H13NO
Molecular Weight:
151.2056
MDL Number:
MFCD03210676
IUPAC Name:
N-ethyl-4-methoxyaniline
InChI:
InChI=1S/C9H13NO/c1-3-10-8-4-6-9(11-2)7-5-8/h4-7,10H,3H2,1-2H3
InChI Key:
MCPNIYHJPMRCQU-UHFFFAOYSA-N
SMILES:
CCNc1ccc(cc1)OC
Properties
Complexity:
97.7  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
151.1g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
151.209g/mol
Monoisotopic Mass:
151.1g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
21.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Properties