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Home > Bromides > 1563017-39-9
1563017-39-9 | 8-Quinolinecarbonitrile, 6-bromo-
CAS No: 1563017-39-9 Catalog No: AG001ONL MDL No:MFCD27923327
Product Description
Catalog Number:
AG001ONL
Chemical Name:
8-Quinolinecarbonitrile, 6-bromo-
CAS Number:
1563017-39-9
Molecular Formula:
C10H5BrN2
Molecular Weight:
233.0641
MDL Number:
MFCD27923327
IUPAC Name:
6-bromoquinoline-8-carbonitrile
InChI:
InChI=1S/C10H5BrN2/c11-9-4-7-2-1-3-13-10(7)8(5-9)6-12/h1-5H
InChI Key:
TZRKTJCKHMMRLR-UHFFFAOYSA-N
SMILES:
N#Cc1cc(Br)cc2c1nccc2
Properties
Complexity:
232
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.964g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
233.068g/mol
Monoisotopic Mass:
231.964g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
36.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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