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5-amino-4-phenyl-1H-pyrazole-3-carboxylic acid

CAS No.:
1238343-38-8
Catalog Number:
AG009DSG
Molecular Formula:
C10H9N3O2
Molecular Weight:
203.1974
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$226
- +
Product Description
Catalog Number:
AG009DSG
Chemical Name:
5-amino-4-phenyl-1H-pyrazole-3-carboxylic acid
CAS Number:
1238343-38-8
Molecular Formula:
C10H9N3O2
Molecular Weight:
203.1974
MDL Number:
MFCD13188573
IUPAC Name:
3-amino-4-phenyl-1H-pyrazole-5-carboxylic acid
InChI:
InChI=1S/C10H9N3O2/c11-9-7(6-4-2-1-3-5-6)8(10(14)15)12-13-9/h1-5H,(H,14,15)(H3,11,12,13)
InChI Key:
NSSYNYUJSLLDSU-UHFFFAOYSA-N
SMILES:
OC(=O)c1n[nH]c(c1c1ccccc1)N
Properties
Complexity:
241  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
203.069g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
203.201g/mol
Monoisotopic Mass:
203.069g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
92A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.4  
Properties