sales@angenesci.com
Login | Register
logo
Structures Search
Home Carboxys 1,4,5,6-Tetrahydro-cyclopentapyrazole-3-carboxylic acid ethyl ester

1,4,5,6-Tetrahydro-cyclopentapyrazole-3-carboxylic acid ethyl ester

CAS No.:
5932-31-0
Catalog Number:
AG00ECA0
Molecular Formula:
C9H12N2O2
Molecular Weight:
180.2038
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$75
- +
5g
95%
In Stock USA
United States
$207
- +
10g
95%
In Stock USA
United States
$382
- +
Product Description
Catalog Number:
AG00ECA0
Chemical Name:
1,4,5,6-Tetrahydro-cyclopentapyrazole-3-carboxylic acid ethyl ester
CAS Number:
5932-31-0
Molecular Formula:
C9H12N2O2
Molecular Weight:
180.2038
MDL Number:
MFCD07778361
IUPAC Name:
ethyl 1,4,5,6-tetrahydrocyclopenta[c]pyrazole-3-carboxylate
InChI:
InChI=1S/C9H12N2O2/c1-2-13-9(12)8-6-4-3-5-7(6)10-11-8/h2-5H2,1H3,(H,10,11)
InChI Key:
NDGAORNQTOHHSU-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1n[nH]c2c1CCC2
Properties
Complexity:
208  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.09g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
180.207g/mol
Monoisotopic Mass:
180.09g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
55A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties