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202865-79-0 | Benzene, 2-bromo-4-fluoro-1-(1-methylethoxy)-
CAS No: 202865-79-0 Catalog No: AG0028I7 MDL No:MFCD00070761
Product Description
Catalog Number:
AG0028I7
Chemical Name:
Benzene, 2-bromo-4-fluoro-1-(1-methylethoxy)-
CAS Number:
202865-79-0
Molecular Formula:
C9H10BrFO
Molecular Weight:
233.0775
MDL Number:
MFCD00070761
IUPAC Name:
2-bromo-4-fluoro-1-propan-2-yloxybenzene
InChI:
InChI=1S/C9H10BrFO/c1-6(2)12-9-4-3-7(11)5-8(9)10/h3-6H,1-2H3
InChI Key:
HFSLIMXPHXLCKX-UHFFFAOYSA-N
SMILES:
CC(Oc1ccc(cc1Br)F)C
Properties
Complexity:
141
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.99g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
233.08g/mol
Monoisotopic Mass:
231.99g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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