Home Other Building Blocks 5-(3,4-dimethylphenyl)-1,2,4-triazin-3-amine

5-(3,4-dimethylphenyl)-1,2,4-triazin-3-amine

CAS No.:
1094385-33-7
Catalog Number:
AG01A9RD
Molecular Formula:
C11H12N4
Molecular Weight:
200.2398
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Product Description
Catalog Number:
AG01A9RD
Chemical Name:
5-(3,4-dimethylphenyl)-1,2,4-triazin-3-amine
CAS Number:
1094385-33-7
Molecular Formula:
C11H12N4
Molecular Weight:
200.2398
MDL Number:
MFCD11134121
IUPAC Name:
5-(3,4-dimethylphenyl)-1,2,4-triazin-3-amine
InChI:
InChI=1S/C11H12N4/c1-7-3-4-9(5-8(7)2)10-6-13-15-11(12)14-10/h3-6H,1-2H3,(H2,12,14,15)
InChI Key:
PYUINXLDECWNGA-UHFFFAOYSA-N
SMILES:
Nc1nncc(n1)c1ccc(c(c1)C)C
Properties
Complexity:
209  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
200.106g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
200.245g/mol
Monoisotopic Mass:
200.106g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
64.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties