Home Carboxys ethyl 1H,2H,3H-pyrazolo[1,5-a]imidazole-7-carboxylate

ethyl 1H,2H,3H-pyrazolo[1,5-a]imidazole-7-carboxylate

CAS No.:
1378779-72-6
Catalog Number:
AG01BGWG
Molecular Formula:
C8H11N3O2
Molecular Weight:
181.1918
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Product Description
Catalog Number:
AG01BGWG
Chemical Name:
ethyl 1H,2H,3H-pyrazolo[1,5-a]imidazole-7-carboxylate
CAS Number:
1378779-72-6
Molecular Formula:
C8H11N3O2
Molecular Weight:
181.1918
MDL Number:
MFCD20684180
IUPAC Name:
ethyl 2,3-dihydro-1H-imidazo[1,2-b]pyrazole-7-carboxylate
InChI:
InChI=1S/C8H11N3O2/c1-2-13-8(12)6-5-10-11-4-3-9-7(6)11/h5,9H,2-4H2,1H3
InChI Key:
QQRZIZCYKJXHFM-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cnn2c1NCC2
Properties
Complexity:
210  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
181.085g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
181.195g/mol
Monoisotopic Mass:
181.085g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
56.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties