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159181-77-8 | 1H-Imidazo[1,2-b]pyrazole-6-carboxylic acid, ethyl ester
CAS No: 159181-77-8 Catalog No: AG001QIY MDL No:
Product Description
Catalog Number:
AG001QIY
Chemical Name:
1H-Imidazo[1,2-b]pyrazole-6-carboxylic acid, ethyl ester
CAS Number:
159181-77-8
Molecular Formula:
C8H9N3O2
Molecular Weight:
179.1760
IUPAC Name:
ethyl 5H-imidazo[1,2-b]pyrazole-6-carboxylate
InChI:
InChI=1S/C8H9N3O2/c1-2-13-8(12)6-5-7-9-3-4-11(7)10-6/h3-5,10H,2H2,1H3
InChI Key:
UUQQCFDWTIEWLT-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cc2n(n1)cc[nH]2
Properties
Complexity:
210
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
179.069g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
179.179g/mol
Monoisotopic Mass:
179.069g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
59.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2
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