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951895-17-3 | 2-Bromo-4-(2-chloro-6-fluorophenyl)-1-butene
CAS No: 951895-17-3 Catalog No: AG01F056 MDL No:
Product Description
Catalog Number:
AG01F056
Chemical Name:
2-Bromo-4-(2-chloro-6-fluorophenyl)-1-butene
CAS Number:
951895-17-3
Molecular Formula:
C10H9BrClF
Molecular Weight:
263.5339
IUPAC Name:
2-(3-bromobut-3-enyl)-1-chloro-3-fluorobenzene
InChI:
InChI=1S/C10H9BrClF/c1-7(11)5-6-8-9(12)3-2-4-10(8)13/h2-4H,1,5-6H2
InChI Key:
ZLZJHBYNZZLYML-UHFFFAOYSA-N
SMILES:
BrC(=C)CCc1c(F)cccc1Cl
Properties
Complexity:
184
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
261.956g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
263.534g/mol
Monoisotopic Mass:
261.956g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.5
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