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627871-16-3 | 5-Bromo-4-fluoro-2-methylaniline
CAS No: 627871-16-3 Catalog No: AG003MJ9 MDL No:MFCD05865218
Product Description
Catalog Number:
AG003MJ9
Chemical Name:
5-Bromo-4-fluoro-2-methylaniline
CAS Number:
627871-16-3
Molecular Formula:
C7H7BrFN
Molecular Weight:
204.0396
MDL Number:
MFCD05865218
IUPAC Name:
5-bromo-4-fluoro-2-methylaniline
InChI:
InChI=1S/C7H7BrFN/c1-4-2-6(9)5(8)3-7(4)10/h2-3H,10H2,1H3
InChI Key:
DNCLVDGUXUSPTL-UHFFFAOYSA-N
SMILES:
Nc1cc(Br)c(cc1C)F
Properties
Complexity:
120
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.975g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
204.042g/mol
Monoisotopic Mass:
202.975g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
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