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832732-40-8 | Benzene, 1,1'-(2,4-dichloro-1-butenylidene)bis[4-fluoro-
CAS No: 832732-40-8 Catalog No: AG004TBD MDL No:
Product Description
Catalog Number:
AG004TBD
Chemical Name:
Benzene, 1,1'-(2,4-dichloro-1-butenylidene)bis[4-fluoro-
CAS Number:
832732-40-8
Molecular Formula:
C16H12Cl2F2
Molecular Weight:
313.1693
IUPAC Name:
1-[2,4-dichloro-1-(4-fluorophenyl)but-1-enyl]-4-fluorobenzene
InChI:
InChI=1S/C16H12Cl2F2/c17-10-9-15(18)16(11-1-5-13(19)6-2-11)12-3-7-14(20)8-4-12/h1-8H,9-10H2
InChI Key:
CWEDWEJOQYCSES-UHFFFAOYSA-N
SMILES:
ClCCC(=C(c1ccc(cc1)F)c1ccc(cc1)F)Cl
Properties
Complexity:
303
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
312.028g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
313.169g/mol
Monoisotopic Mass:
312.028g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.9
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