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951889-05-7 | 2-Bromo-3-(3-fluoro-5-methoxyphenyl)-1-propene
CAS No: 951889-05-7 Catalog No: AG01EZT2 MDL No:
Product Description
Catalog Number:
AG01EZT2
Chemical Name:
2-Bromo-3-(3-fluoro-5-methoxyphenyl)-1-propene
CAS Number:
951889-05-7
Molecular Formula:
C10H10BrFO
Molecular Weight:
245.0882
IUPAC Name:
1-(2-bromoprop-2-enyl)-3-fluoro-5-methoxybenzene
InChI:
InChI=1S/C10H10BrFO/c1-7(11)3-8-4-9(12)6-10(5-8)13-2/h4-6H,1,3H2,2H3
InChI Key:
DDSDJLXHJSHQQL-UHFFFAOYSA-N
SMILES:
COc1cc(CC(=C)Br)cc(c1)F
Properties
Complexity:
184
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.99g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
245.091g/mol
Monoisotopic Mass:
243.99g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.5
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