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127296-34-8 | Benzene, 1-[3-bromo-2-(4-fluorophenyl)-1-propenyl]-2-chloro-, (Z)- (9CI)
CAS No: 127296-34-8 Catalog No: AG000WW9 MDL No:MFCD26940219
Product Description
Catalog Number:
AG000WW9
Chemical Name:
Benzene, 1-[3-bromo-2-(4-fluorophenyl)-1-propenyl]-2-chloro-, (Z)- (9CI)
CAS Number:
127296-34-8
Molecular Formula:
C15H11BrClF
Molecular Weight:
325.6032
MDL Number:
MFCD26940219
IUPAC Name:
1-[(E)-3-bromo-1-(2-chlorophenyl)prop-1-en-2-yl]-4-fluorobenzene
InChI:
InChI=1S/C15H11BrClF/c16-10-13(11-5-7-14(18)8-6-11)9-12-3-1-2-4-15(12)17/h1-9H,10H2/b13-9-
InChI Key:
YNNRHMAGCCHGCT-LCYFTJDESA-N
SMILES:
BrC/C(=C\c1ccccc1Cl)/c1ccc(cc1)F
Properties
Complexity:
284
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1
Exact Mass:
323.972g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
325.605g/mol
Monoisotopic Mass:
323.972g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.7
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