Home Aminos 3-(3-amino-4-methylphenyl)-4,5-dihydro-1H-1,2,4-triazol-5-one

3-(3-amino-4-methylphenyl)-4,5-dihydro-1H-1,2,4-triazol-5-one

CAS No.:
1248756-57-1
Catalog Number:
AG01BHKL
Molecular Formula:
C9H10N4O
Molecular Weight:
190.2019
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Product Description
Catalog Number:
AG01BHKL
Chemical Name:
3-(3-amino-4-methylphenyl)-4,5-dihydro-1H-1,2,4-triazol-5-one
CAS Number:
1248756-57-1
Molecular Formula:
C9H10N4O
Molecular Weight:
190.2019
MDL Number:
MFCD14640875
IUPAC Name:
3-(3-amino-4-methylphenyl)-1,4-dihydro-1,2,4-triazol-5-one
InChI:
InChI=1S/C9H10N4O/c1-5-2-3-6(4-7(5)10)8-11-9(14)13-12-8/h2-4H,10H2,1H3,(H2,11,12,13,14)
InChI Key:
LHDQGIBOUWGEEL-UHFFFAOYSA-N
SMILES:
Cc1ccc(cc1N)c1n[nH]c(=O)[nH]1
Properties
Complexity:
276  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
190.085g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
190.206g/mol
Monoisotopic Mass:
190.085g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
79.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties