Home Carboxys 5-cyclopropyl-1-propyl-1H-pyrazole-4-carboxylic acid

5-cyclopropyl-1-propyl-1H-pyrazole-4-carboxylic acid

CAS No.:
1248463-84-4
Catalog Number:
AG01A3MU
Molecular Formula:
C10H14N2O2
Molecular Weight:
194.2304
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Product Description
Catalog Number:
AG01A3MU
Chemical Name:
5-cyclopropyl-1-propyl-1H-pyrazole-4-carboxylic acid
CAS Number:
1248463-84-4
Molecular Formula:
C10H14N2O2
Molecular Weight:
194.2304
MDL Number:
MFCD14609323
IUPAC Name:
5-cyclopropyl-1-propylpyrazole-4-carboxylic acid
InChI:
InChI=1S/C10H14N2O2/c1-2-5-12-9(7-3-4-7)8(6-11-12)10(13)14/h6-7H,2-5H2,1H3,(H,13,14)
InChI Key:
WWUNMMVQRSQKDK-UHFFFAOYSA-N
SMILES:
CCCn1ncc(c1C1CC1)C(=O)O
Properties
Complexity:
228  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
194.106g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
194.234g/mol
Monoisotopic Mass:
194.106g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
55.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Properties