Home Other Building Blocks 4-(1H-imidazol-1-yl)-3-methylaniline

4-(1H-imidazol-1-yl)-3-methylaniline

CAS No.:
461664-00-6
Catalog Number:
AG01AAFL
Molecular Formula:
C10H11N3
Molecular Weight:
173.2144
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Product Description
Catalog Number:
AG01AAFL
Chemical Name:
4-(1H-imidazol-1-yl)-3-methylaniline
CAS Number:
461664-00-6
Molecular Formula:
C10H11N3
Molecular Weight:
173.2144
MDL Number:
MFCD11106415
IUPAC Name:
4-imidazol-1-yl-3-methylaniline
InChI:
InChI=1S/C10H11N3/c1-8-6-9(11)2-3-10(8)13-5-4-12-7-13/h2-7H,11H2,1H3
InChI Key:
IDERBIIMSOEWBR-UHFFFAOYSA-N
SMILES:
Nc1ccc(c(c1)C)n1cncc1
Properties
Complexity:
172  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.095g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
173.219g/mol
Monoisotopic Mass:
173.095g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
43.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties