Home Halogens 4-bromo-3-fluoro-N,N-dimethylbenzamide

4-bromo-3-fluoro-N,N-dimethylbenzamide

CAS No.:
893420-59-2
Catalog Number:
AG01BB4F
Molecular Formula:
C9H9BrFNO
Molecular Weight:
246.0763
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Product Description
Catalog Number:
AG01BB4F
Chemical Name:
4-bromo-3-fluoro-N,N-dimethylbenzamide
CAS Number:
893420-59-2
Molecular Formula:
C9H9BrFNO
Molecular Weight:
246.0763
MDL Number:
MFCD16084889
IUPAC Name:
4-bromo-3-fluoro-N,N-dimethylbenzamide
InChI:
InChI=1S/C9H9BrFNO/c1-12(2)9(13)6-3-4-7(10)8(11)5-6/h3-5H,1-2H3
InChI Key:
SQSHZRBCVHCKPX-UHFFFAOYSA-N
SMILES:
CN(C(=O)c1ccc(c(c1)F)Br)C
Properties
Complexity:
198  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.985g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
246.079g/mol
Monoisotopic Mass:
244.985g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
20.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties