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Home > Bromides > 1190311-11-5
1190311-11-5 | 1H-Pyrrolo[2,3-c]pyridine-7-carbonitrile, 3-bromo-4-fluoro-
CAS No: 1190311-11-5 Catalog No: AG000HHU MDL No:
Product Description
Catalog Number:
AG000HHU
Chemical Name:
1H-Pyrrolo[2,3-c]pyridine-7-carbonitrile, 3-bromo-4-fluoro-
CAS Number:
1190311-11-5
Molecular Formula:
C8H3BrFN3
Molecular Weight:
240.0319
IUPAC Name:
3-bromo-4-fluoro-1H-pyrrolo[2,3-c]pyridine-7-carbonitrile
InChI:
InChI=1S/C8H3BrFN3/c9-4-2-13-8-6(1-11)12-3-5(10)7(4)8/h2-3,13H
InChI Key:
UFIAQWXDEIVDEK-UHFFFAOYSA-N
SMILES:
N#Cc1ncc(c2c1[nH]cc2Br)F
Properties
Complexity:
251
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.949g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
240.035g/mol
Monoisotopic Mass:
238.949g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
52.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8
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