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951892-31-2 | 2-Bromo-4-(2,5-difluorophenyl)-1-butene
CAS No: 951892-31-2 Catalog No: AG01F00B MDL No:
Product Description
Catalog Number:
AG01F00B
Chemical Name:
2-Bromo-4-(2,5-difluorophenyl)-1-butene
CAS Number:
951892-31-2
Molecular Formula:
C10H9BrF2
Molecular Weight:
247.0793
IUPAC Name:
2-(3-bromobut-3-enyl)-1,4-difluorobenzene
InChI:
InChI=1S/C10H9BrF2/c1-7(11)2-3-8-6-9(12)4-5-10(8)13/h4-6H,1-3H2
InChI Key:
FKOCCRTYVKDXHU-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1CCC(=C)Br)F
Properties
Complexity:
182
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
245.986g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
247.083g/mol
Monoisotopic Mass:
245.986g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4
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