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Home > Aldehydes > 1556231-57-2
1556231-57-2 | 8-Quinolinecarboxaldehyde, 3-bromo-
CAS No: 1556231-57-2 Catalog No: AG001O2E MDL No:
Product Description
Catalog Number:
AG001O2E
Chemical Name:
8-Quinolinecarboxaldehyde, 3-bromo-
CAS Number:
1556231-57-2
Molecular Formula:
C10H6BrNO
Molecular Weight:
236.0647
IUPAC Name:
3-bromoquinoline-8-carbaldehyde
InChI:
InChI=1S/C10H6BrNO/c11-9-4-7-2-1-3-8(6-13)10(7)12-5-9/h1-6H
InChI Key:
AXABLSRVYDFNNR-UHFFFAOYSA-N
SMILES:
O=Cc1cccc2c1ncc(c2)Br
Properties
Complexity:
197
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.963g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
236.068g/mol
Monoisotopic Mass:
234.963g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3
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