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Home > Aldehydes > 1227572-94-2
1227572-94-2 | 4-Pyridinecarboxaldehyde, 2-bromo-3-fluoro-
CAS No: 1227572-94-2 Catalog No: AG000JB6 MDL No:MFCD16606504
Product Description
Catalog Number:
AG000JB6
Chemical Name:
4-Pyridinecarboxaldehyde, 2-bromo-3-fluoro-
CAS Number:
1227572-94-2
Molecular Formula:
C6H3BrFNO
Molecular Weight:
203.9965
MDL Number:
MFCD16606504
IUPAC Name:
2-bromo-3-fluoropyridine-4-carbaldehyde;hydrate
InChI:
InChI=1S/C6H3BrFNO.H2O/c7-6-5(8)4(3-10)1-2-9-6;/h1-3H;1H2
InChI Key:
FYISHJPSPNVIGM-UHFFFAOYSA-N
SMILES:
O=Cc1ccnc(c1F)Br
Properties
Complexity:
133
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
220.949g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
222.013g/mol
Monoisotopic Mass:
220.949g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
31A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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