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Cyclopentapyrazole-3-carboxylic acid

CAS No.:
5932-32-1
Catalog Number:
AG0032M4
Molecular Formula:
C7H8N2O2
Molecular Weight:
152.1506
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$80
- +
5g
95%
In Stock USA
United States
$216
- +
10g
98%
In Stock USA
United States
$432
- +
25g
98%
In Stock USA
United States
$857
- +
Product Description
Catalog Number:
AG0032M4
Chemical Name:
Cyclopentapyrazole-3-carboxylic acid
CAS Number:
5932-32-1
Molecular Formula:
C7H8N2O2
Molecular Weight:
152.1506
MDL Number:
MFCD01248822
IUPAC Name:
1,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carboxylic acid
InChI:
InChI=1S/C7H8N2O2/c10-7(11)6-4-2-1-3-5(4)8-9-6/h1-3H2,(H,8,9)(H,10,11)
InChI Key:
FCYBBDFUBSEGMX-UHFFFAOYSA-N
SMILES:
OC(=O)c1n[nH]c2c1CCC2
Properties
Complexity:
183  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
152.059g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
152.153g/mol
Monoisotopic Mass:
152.059g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Literature
Title Journal
Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. Bioorganic & medicinal chemistry letters 20101101
Nicotinic acid receptor agonists. Journal of medicinal chemistry 20081225
3-(1H-tetrazol-5-yl)-1,4,5,6-tetrahydro-cyclopentapyrazole (MK-0354): a partial agonist of the nicotinic acid receptor, G-protein coupled receptor 109a, with antilipolytic but no vasodilatory activity in mice. Journal of medicinal chemistry 20080828
Agonist lead identification for the high affinity niacin receptor GPR109a. Bioorganic & medicinal chemistry letters 20070901
Pyrazole derivatives as partial agonists for the nicotinic acid receptor. Journal of medicinal chemistry 20030828
Properties