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Home > Bromides > 1251351-08-2
1251351-08-2 | Benzamide, 4-bromo-N-ethyl-3-fluoro-
CAS No: 1251351-08-2 Catalog No: AG000N8D MDL No:MFCD16084877
Product Description
Catalog Number:
AG000N8D
Chemical Name:
Benzamide, 4-bromo-N-ethyl-3-fluoro-
CAS Number:
1251351-08-2
Molecular Formula:
C9H9BrFNO
Molecular Weight:
246.0763
MDL Number:
MFCD16084877
IUPAC Name:
4-bromo-N-ethyl-3-fluorobenzamide
InChI:
InChI=1S/C9H9BrFNO/c1-2-12-9(13)6-3-4-7(10)8(11)5-6/h3-5H,2H2,1H3,(H,12,13)
InChI Key:
RANSMOUZDHCGGN-UHFFFAOYSA-N
SMILES:
CCNC(=O)c1ccc(c(c1)F)Br
Properties
Complexity:
189
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:
1
Isotope Atom Count:
0
Molecular Weight:
246.079g/mol
Monoisotopic Mass:
244.985g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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