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1528500-29-9 | 1-{4H,5H,6H,7H-pyrazolo[1,5-a]pyridin-2-yl}ethan-1-one
CAS No: 1528500-29-9 Catalog No: AG01C3KA MDL No:MFCD29906838
Product Description
Catalog Number:
AG01C3KA
Chemical Name:
1-{4H,5H,6H,7H-pyrazolo[1,5-a]pyridin-2-yl}ethan-1-one
CAS Number:
1528500-29-9
Molecular Formula:
C9H12N2O
Molecular Weight:
164.2044
MDL Number:
MFCD29906838
IUPAC Name:
1-(4,5,6,7-tetrahydropyrazolo[1,5-a]pyridin-2-yl)ethanone
InChI:
InChI=1S/C9H12N2O/c1-7(12)9-6-8-4-2-3-5-11(8)10-9/h6H,2-5H2,1H3
InChI Key:
XVSMJKPTSVSBAS-UHFFFAOYSA-N
SMILES:
CC(=O)c1cc2n(n1)CCCC2
Properties
Complexity:
193
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.095g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
164.208g/mol
Monoisotopic Mass:
164.095g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
34.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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