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1422-53-3 | Benzene, 2-bromo-4-fluoro-1-methyl-
CAS No: 1422-53-3 Catalog No: AG001HYE MDL No:MFCD00040828
Product Description
Catalog Number:
AG001HYE
Chemical Name:
Benzene, 2-bromo-4-fluoro-1-methyl-
CAS Number:
1422-53-3
Molecular Formula:
C7H6BrF
Molecular Weight:
189.0249
MDL Number:
MFCD00040828
IUPAC Name:
2-bromo-4-fluoro-1-methylbenzene
InChI:
InChI=1S/C7H6BrF/c1-5-2-3-6(9)4-7(5)8/h2-4H,1H3
InChI Key:
SFGFOJPGCOYQJK-UHFFFAOYSA-N
SMILES:
Fc1ccc(c(c1)Br)C
EC Number:
215-830-0
Properties
Complexity:
94.9
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.964g/mol
Formal Charge:
0
Heavy Atom Count:
9
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
189.027g/mol
Monoisotopic Mass:
187.964g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1
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