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Home > Bromides > 1772047-98-9
1772047-98-9 | 1-Bromo-4-fluoro-3-n-hexyloxybenzene
CAS No: 1772047-98-9 Catalog No: AG01EUDN MDL No:
Product Description
Catalog Number:
AG01EUDN
Chemical Name:
1-Bromo-4-fluoro-3-n-hexyloxybenzene
CAS Number:
1772047-98-9
Molecular Formula:
C12H16BrFO
Molecular Weight:
275.1572
IUPAC Name:
4-bromo-1-fluoro-2-hexoxybenzene
InChI:
InChI=1S/C12H16BrFO/c1-2-3-4-5-8-15-12-9-10(13)6-7-11(12)14/h6-7,9H,2-5,8H2,1H3
InChI Key:
MJMMQLMGWYBNMZ-UHFFFAOYSA-N
SMILES:
CCCCCCOc1cc(Br)ccc1F
Properties
Complexity:
166
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
274.037g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
275.161g/mol
Monoisotopic Mass:
274.037g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5
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