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5100-97-0 | 1-Bromo-2-fluoro-4,5-dimethylbenzene
CAS No: 5100-97-0 Catalog No: AG003A6M MDL No:MFCD08695022
Product Description
Catalog Number:
AG003A6M
Chemical Name:
1-Bromo-2-fluoro-4,5-dimethylbenzene
CAS Number:
5100-97-0
Molecular Formula:
C8H8BrF
Molecular Weight:
203.0515
MDL Number:
MFCD08695022
IUPAC Name:
1-bromo-2-fluoro-4,5-dimethylbenzene
InChI:
InChI=1S/C8H8BrF/c1-5-3-7(9)8(10)4-6(5)2/h3-4H,1-2H3
InChI Key:
QAQMEWQVHCIKMW-UHFFFAOYSA-N
SMILES:
Cc1cc(Br)c(cc1C)F
Properties
Complexity:
116
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
201.979g/mol
Formal Charge:
0
Heavy Atom Count:
10
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
203.054g/mol
Monoisotopic Mass:
201.979g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4
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