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Home Other Building Blocks 5-Phenyl-4H-1,2,4-triazol-3-amine

5-Phenyl-4H-1,2,4-triazol-3-amine

CAS No.:
4922-98-9
Catalog Number:
AG00377E
Molecular Formula:
C8H8N4
Molecular Weight:
160.1759
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$74
- +
1g
95%
In Stock USA
United States
$192
- +
Product Description
Catalog Number:
AG00377E
Chemical Name:
5-Phenyl-4H-1,2,4-triazol-3-amine
CAS Number:
4922-98-9
Molecular Formula:
C8H8N4
Molecular Weight:
160.1759
MDL Number:
MFCD00086332
IUPAC Name:
5-phenyl-1H-1,2,4-triazol-3-amine
InChI:
InChI=1S/C8H8N4/c9-8-10-7(11-12-8)6-4-2-1-3-5-6/h1-5H,(H3,9,10,11,12)
InChI Key:
GHUDJFJZFUVPIQ-UHFFFAOYSA-N
SMILES:
Nc1nnc([nH]1)c1ccccc1
UNII:
QA2L2ED2R9
Properties
Complexity:
144  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
160.075g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
160.18g/mol
Monoisotopic Mass:
160.075g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
67.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Literature
Title Journal
N-Carbethoxy-N'-(3-phenyl-1H-1,2,4-triazol-5-yl)thiourea. Acta crystallographica. Section E, Structure reports online 20100201
3-Phenyl-1H-1,2,4-triazol-5-amine-5-phenyl-1H-1,2,4-triazol-3-amine (1/1). Acta crystallographica. Section E, Structure reports online 20090101
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties