Home Carboxys 5-Cyclopropyl-1h-pyrazole-4-carboxylic acid

5-Cyclopropyl-1h-pyrazole-4-carboxylic acid

CAS No.:
870704-26-0
Catalog Number:
AG004N9I
Molecular Formula:
C7H8N2O2
Molecular Weight:
152.1506
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Product Description
Catalog Number:
AG004N9I
Chemical Name:
5-Cyclopropyl-1h-pyrazole-4-carboxylic acid
CAS Number:
870704-26-0
Molecular Formula:
C7H8N2O2
Molecular Weight:
152.1506
MDL Number:
MFCD06798101
IUPAC Name:
5-cyclopropyl-1H-pyrazole-4-carboxylic acid
InChI:
InChI=1S/C7H8N2O2/c10-7(11)5-3-8-9-6(5)4-1-2-4/h3-4H,1-2H2,(H,8,9)(H,10,11)
InChI Key:
BDRDAUXEHDELHS-UHFFFAOYSA-N
SMILES:
OC(=O)c1c[nH]nc1C1CC1
Properties
Complexity:
179  
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:
2  
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.3  
Properties