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Home > Bromides > 1379310-91-4
1379310-91-4 | 2-Bromo-3-(3,4-difluoro-5-methoxyphenyl)-1-propene
CAS No: 1379310-91-4 Catalog No: AG01F916 MDL No:
Product Description
Catalog Number:
AG01F916
Chemical Name:
2-Bromo-3-(3,4-difluoro-5-methoxyphenyl)-1-propene
CAS Number:
1379310-91-4
Molecular Formula:
C10H9BrF2O
Molecular Weight:
263.0787
IUPAC Name:
5-(2-bromoprop-2-enyl)-1,2-difluoro-3-methoxybenzene
InChI:
InChI=1S/C10H9BrF2O/c1-6(11)3-7-4-8(12)10(13)9(5-7)14-2/h4-5H,1,3H2,2H3
InChI Key:
WJRCUBFTQITKHY-UHFFFAOYSA-N
SMILES:
COc1cc(CC(=C)Br)cc(c1F)F
Properties
Complexity:
210
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.98g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
263.082g/mol
Monoisotopic Mass:
261.98g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.6
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