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146447-18-9 | Benzene, 1-bromo-4-chloro-2-fluoro-5-methoxy-
CAS No: 146447-18-9 Catalog No: AG001E1T MDL No:MFCD07784265
Product Description
Catalog Number:
AG001E1T
Chemical Name:
Benzene, 1-bromo-4-chloro-2-fluoro-5-methoxy-
CAS Number:
146447-18-9
Molecular Formula:
C7H5BrClFO
Molecular Weight:
239.4694
MDL Number:
MFCD07784265
IUPAC Name:
1-bromo-4-chloro-2-fluoro-5-methoxybenzene
InChI:
InChI=1S/C7H5BrClFO/c1-11-7-2-4(8)6(10)3-5(7)9/h2-3H,1H3
InChI Key:
KHRHCBZTZQFNDK-UHFFFAOYSA-N
SMILES:
COc1cc(Br)c(cc1Cl)F
Properties
Complexity:
136
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.92g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
239.468g/mol
Monoisotopic Mass:
237.92g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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