Home Other Building Blocks 2-Bromo-3-fluoro-1-methylpyridin-4(1H)-one

2-Bromo-3-fluoro-1-methylpyridin-4(1H)-one

CAS No.:
1312440-89-3
Catalog Number:
AG009DES
Molecular Formula:
C6H5BrFNO
Molecular Weight:
206.0124
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Product Description
Catalog Number:
AG009DES
Chemical Name:
2-Bromo-3-fluoro-1-methylpyridin-4(1H)-one
CAS Number:
1312440-89-3
Molecular Formula:
C6H5BrFNO
Molecular Weight:
206.0124
MDL Number:
MFCD19288877
IUPAC Name:
2-bromo-3-fluoro-1-methylpyridin-4-one
InChI:
InChI=1S/C6H5BrFNO/c1-9-3-2-4(10)5(8)6(9)7/h2-3H,1H3
InChI Key:
FMSCDNIXOALVPD-UHFFFAOYSA-N
SMILES:
Cn1ccc(=O)c(c1Br)F
Properties
Complexity:
234  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
204.954g/mol
Formal Charge:
0
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
206.014g/mol
Monoisotopic Mass:
204.954g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties