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Home > Aldehydes > 898559-24-5
898559-24-5 | 3-Bromoquinoline-2-carbaldehyde
CAS No: 898559-24-5 Catalog No: AG003X2Y MDL No:MFCD08669940
Product Description
Catalog Number:
AG003X2Y
Chemical Name:
3-Bromoquinoline-2-carbaldehyde
CAS Number:
898559-24-5
Molecular Formula:
C10H6BrNO
Molecular Weight:
236.0647
MDL Number:
MFCD08669940
IUPAC Name:
3-bromoquinoline-2-carbaldehyde
InChI:
InChI=1S/C10H6BrNO/c11-8-5-7-3-1-2-4-9(7)12-10(8)6-13/h1-6H
InChI Key:
PJFNHALOBWCFMD-UHFFFAOYSA-N
SMILES:
O=Cc1nc2ccccc2cc1Br
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:
2.7
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