3-Cyclopentapyrazolecarboxylic acid, 1,4,5,6-tetrahydro-, ethyl ester


Chemical Name: 3-Cyclopentapyrazolecarboxylic acid, 1,4,5,6-tetrahydro-, ethyl ester
CAS Number: 5932-31-0
Product Number: AG00ECA0(AGN-PC-03X8TA)
Synonyms:
MDL No:
Molecular Formula: C9H12N2O2
Molecular Weight: 180.2038

Identification/Properties


Properties
Storage:
2-8℃;Keep in dry area;
Form:
Solid
Computed Properties
Molecular Weight:
180.207g/mol
XLogP3:
1.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
180.09g/mol
Monoisotopic Mass:
180.09g/mol
Topological Polar Surface Area:
55A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
208
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H315-H320-H335
Precautionary Statements:
P261-P280-P301+P312-P302+P352-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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