Home Other Building Blocks N-methyl-5-phenyl-4H-1,2,4-triazol-3-amine hydrochloride

N-methyl-5-phenyl-4H-1,2,4-triazol-3-amine hydrochloride

CAS No.:
54463-82-0
Catalog Number:
AG01C4LW
Molecular Formula:
C9H11ClN4
Molecular Weight:
210.6634
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Product Description
Catalog Number:
AG01C4LW
Chemical Name:
N-methyl-5-phenyl-4H-1,2,4-triazol-3-amine hydrochloride
CAS Number:
54463-82-0
Molecular Formula:
C9H11ClN4
Molecular Weight:
210.6634
MDL Number:
MFCD29763175
IUPAC Name:
N-methyl-5-phenyl-1H-1,2,4-triazol-3-amine;hydrochloride
InChI:
InChI=1S/C9H10N4.ClH/c1-10-9-11-8(12-13-9)7-5-3-2-4-6-7;/h2-6H,1H3,(H2,10,11,12,13);1H
InChI Key:
CTFBOSPFGUFUSI-UHFFFAOYSA-N
SMILES:
CNc1nnc([nH]1)c1ccccc1.Cl
Properties
Complexity:
156  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.067g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
210.665g/mol
Monoisotopic Mass:
210.067g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
53.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties