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

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

CAS No.:
858000-93-8
Catalog Number:
AG01A0FN
Molecular Formula:
C10H12N4
Molecular Weight:
188.2291
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Product Description
Catalog Number:
AG01A0FN
Chemical Name:
2-(dimethyl-1H-1,2,4-triazol-1-yl)aniline
CAS Number:
858000-93-8
Molecular Formula:
C10H12N4
Molecular Weight:
188.2291
MDL Number:
MFCD14630650
IUPAC Name:
2-(3,5-dimethyl-1,2,4-triazol-1-yl)aniline
InChI:
InChI=1S/C10H12N4/c1-7-12-8(2)14(13-7)10-6-4-3-5-9(10)11/h3-6H,11H2,1-2H3
InChI Key:
YMRCSZSITNDYBS-UHFFFAOYSA-N
SMILES:
Cc1nn(c(n1)C)c1ccccc1N
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:
1.8  
Properties