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114897-97-1 | Imidazo[1,5-a]pyridine-1-carbonyl chloride, 2,3-dihydro-3-oxo-
CAS No: 114897-97-1 Catalog No: AG000FE6 MDL No:
Product Description
Catalog Number:
AG000FE6
Chemical Name:
Imidazo[1,5-a]pyridine-1-carbonyl chloride, 2,3-dihydro-3-oxo-
CAS Number:
114897-97-1
Molecular Formula:
C8H5ClN2O2
Molecular Weight:
196.5905
IUPAC Name:
3-oxo-2H-imidazo[1,5-a]pyridine-1-carbonyl chloride
InChI:
InChI=1S/C8H5ClN2O2/c9-7(12)6-5-3-1-2-4-11(5)8(13)10-6/h1-4H,(H,10,13)
InChI Key:
VHENJXJSTORTSU-UHFFFAOYSA-N
SMILES:
ClC(=O)c1[nH]c(=O)n2c1cccc2
Properties
Complexity:
382
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.004g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
196.59g/mol
Monoisotopic Mass:
196.004g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
49.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1
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