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Home > Aldehydes > 131747-63-2
131747-63-2 | 2-Pyridinecarboxaldehyde, 4-bromo-
CAS No: 131747-63-2 Catalog No: AG000ZO7 MDL No:MFCD08690697
Product Description
Catalog Number:
AG000ZO7
Chemical Name:
2-Pyridinecarboxaldehyde, 4-bromo-
CAS Number:
131747-63-2
Molecular Formula:
C6H4BrNO
Molecular Weight:
186.0061
MDL Number:
MFCD08690697
IUPAC Name:
4-bromopyridine-2-carbaldehyde
InChI:
InChI=1S/C6H4BrNO/c7-5-1-2-8-6(3-5)4-9/h1-4H
InChI Key:
CKVQWOKUEZYWRQ-UHFFFAOYSA-N
SMILES:
Brc1cc(C=O)ncc1
Properties
Complexity:
107
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
184.948g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
186.008g/mol
Monoisotopic Mass:
184.948g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
30A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3
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