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1228665-90-4 | 1H-Pyrrolo[2,3-b]pyridine, 4-chloro-5-fluoro-3-iodo-
CAS No: 1228665-90-4 Catalog No: AG000JMO MDL No:MFCD16628257
Product Description
Catalog Number:
AG000JMO
Chemical Name:
1H-Pyrrolo[2,3-b]pyridine, 4-chloro-5-fluoro-3-iodo-
CAS Number:
1228665-90-4
Molecular Formula:
C7H3ClFIN2
Molecular Weight:
296.4680
MDL Number:
MFCD16628257
IUPAC Name:
4-chloro-5-fluoro-3-iodo-1H-pyrrolo[2,3-b]pyridine
InChI:
InChI=1S/C7H3ClFIN2/c8-6-3(9)1-11-7-5(6)4(10)2-12-7/h1-2H,(H,11,12)
InChI Key:
GQIXDQQTKUFJIN-UHFFFAOYSA-N
SMILES:
Fc1cnc2c(c1Cl)c(I)c[nH]2
Properties
Complexity:
183
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
295.901g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
296.468g/mol
Monoisotopic Mass:
295.901g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
28.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
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