Home Carboxys 1-Phenyl-1H-pyrazole-5-carboxylic acid

1-Phenyl-1H-pyrazole-5-carboxylic acid

CAS No.:
1133-77-3
Catalog Number:
AG0081U6
Molecular Formula:
C10H8N2O2
Molecular Weight:
188.1827
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$118
- +
5g
98%
In Stock USA
United States
$350
- +
25g
98%
In Stock USA
United States
$1200
- +
Product Description
Catalog Number:
AG0081U6
Chemical Name:
1-Phenyl-1H-pyrazole-5-carboxylic acid
CAS Number:
1133-77-3
Molecular Formula:
C10H8N2O2
Molecular Weight:
188.1827
MDL Number:
MFCD00463580
IUPAC Name:
2-phenylpyrazole-3-carboxylic acid
InChI:
InChI=1S/C10H8N2O2/c13-10(14)9-6-7-11-12(9)8-4-2-1-3-5-8/h1-7H,(H,13,14)
InChI Key:
FLYDUXCFCARXHI-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccnn1c1ccccc1
NSC Number:
40268
Properties
Complexity:
214  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.059g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
188.186g/mol
Monoisotopic Mass:
188.059g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties