Home Carboxys 2-Chloro-4-(1h-pyrazol-1-yl)benzenecarboxylic acid

2-Chloro-4-(1h-pyrazol-1-yl)benzenecarboxylic acid

CAS No.:
313674-12-3
Catalog Number:
AG00CK3A
Molecular Formula:
C10H7ClN2O2
Molecular Weight:
222.6278
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
In Stock USA
United States
$100
- +
1g
98%
In Stock USA
United States
$188
- +
5g
98%
In Stock USA
United States
$563
- +
25g
98%
In Stock USA
United States
$1688
- +
Product Description
Catalog Number:
AG00CK3A
Chemical Name:
2-Chloro-4-(1h-pyrazol-1-yl)benzenecarboxylic acid
CAS Number:
313674-12-3
Molecular Formula:
C10H7ClN2O2
Molecular Weight:
222.6278
MDL Number:
MFCD03425733
IUPAC Name:
2-chloro-4-pyrazol-1-ylbenzoic acid
InChI:
InChI=1S/C10H7ClN2O2/c11-9-6-7(13-5-1-4-12-13)2-3-8(9)10(14)15/h1-6H,(H,14,15)
InChI Key:
JBLRHBKKTPDCTI-UHFFFAOYSA-N
SMILES:
OC(=O)c1ccc(cc1Cl)n1cccn1
Properties
Complexity:
250  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.02g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
222.628g/mol
Monoisotopic Mass:
222.02g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Properties