Home Other Building Blocks 3-(dimethyl-4H-1,2,4-triazol-3-yl)aniline

3-(dimethyl-4H-1,2,4-triazol-3-yl)aniline

CAS No.:
1247670-36-5
Catalog Number:
AG01A18U
Molecular Formula:
C10H12N4
Molecular Weight:
188.2291
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Product Description
Catalog Number:
AG01A18U
Chemical Name:
3-(dimethyl-4H-1,2,4-triazol-3-yl)aniline
CAS Number:
1247670-36-5
Molecular Formula:
C10H12N4
Molecular Weight:
188.2291
MDL Number:
MFCD14639068
IUPAC Name:
3-(4,5-dimethyl-1,2,4-triazol-3-yl)aniline
InChI:
InChI=1S/C10H12N4/c1-7-12-13-10(14(7)2)8-4-3-5-9(11)6-8/h3-6H,11H2,1-2H3
InChI Key:
ZNIZTSHAMGPJNT-UHFFFAOYSA-N
SMILES:
Nc1cccc(c1)c1nnc(n1C)C
Properties
Complexity:
197  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.106g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
188.234g/mol
Monoisotopic Mass:
188.106g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
56.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties