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477956-04-0 | 1-Bromo-3-allyloxy-5-fluorobenzene
CAS No: 477956-04-0 Catalog No: AG01EW41 MDL No:
Product Description
Catalog Number:
AG01EW41
Chemical Name:
1-Bromo-3-allyloxy-5-fluorobenzene
CAS Number:
477956-04-0
Molecular Formula:
C9H8BrFO
Molecular Weight:
231.0616
IUPAC Name:
1-bromo-3-fluoro-5-prop-2-enoxybenzene
InChI:
InChI=1S/C9H8BrFO/c1-2-3-12-9-5-7(10)4-8(11)6-9/h2,4-6H,1,3H2
InChI Key:
SDGUHJAZKCARDF-UHFFFAOYSA-N
SMILES:
C=CCOc1cc(F)cc(c1)Br
Properties
Complexity:
152
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
229.974g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
231.064g/mol
Monoisotopic Mass:
229.974g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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