Home Carboxys 1H,4H,5H,6H-cyclopenta[c]pyrazole-6-carboxylic acid hydrochloride

1H,4H,5H,6H-cyclopenta[c]pyrazole-6-carboxylic acid hydrochloride

CAS No.:
2138043-59-9
Catalog Number:
AG01EKO3
Molecular Formula:
C7H9ClN2O2
Molecular Weight:
188.6116
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Product Description
Catalog Number:
AG01EKO3
Chemical Name:
1H,4H,5H,6H-cyclopenta[c]pyrazole-6-carboxylic acid hydrochloride
CAS Number:
2138043-59-9
Molecular Formula:
C7H9ClN2O2
Molecular Weight:
188.6116
MDL Number:
MFCD31558978
IUPAC Name:
1,4,5,6-tetrahydrocyclopenta[c]pyrazole-6-carboxylic acid;hydrochloride
InChI:
InChI=1S/C7H8N2O2.ClH/c10-7(11)5-2-1-4-3-8-9-6(4)5;/h3,5H,1-2H2,(H,8,9)(H,10,11);1H
InChI Key:
DWCPXDSOLLNBPE-UHFFFAOYSA-N
SMILES:
OC(=O)C1CCc2c1[nH]nc2.Cl
Properties
Complexity:
183  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
188.035g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
188.611g/mol
Monoisotopic Mass:
188.035g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
66A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
Properties