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Home > Fluorides > 145698-29-9
145698-29-9 | Benzene, 1-[4-(4-fluorophenyl)-1,3-butadiynyl]-4-propyl- (9CI)
CAS No: 145698-29-9 Catalog No: AG001DAV MDL No:
Product Description
Catalog Number:
AG001DAV
Chemical Name:
Benzene, 1-[4-(4-fluorophenyl)-1,3-butadiynyl]-4-propyl- (9CI)
CAS Number:
145698-29-9
Molecular Formula:
C19H15F
Molecular Weight:
262.3208
IUPAC Name:
1-fluoro-4-[4-(4-propylphenyl)buta-1,3-diynyl]benzene
InChI:
InChI=1S/C19H15F/c1-2-5-16-8-10-17(11-9-16)6-3-4-7-18-12-14-19(20)15-13-18/h8-15H,2,5H2,1H3
InChI Key:
RSWPKHSEOFVJBM-UHFFFAOYSA-N
SMILES:
CCCc1ccc(cc1)C#CC#Cc1ccc(cc1)F
Properties
Complexity:
408
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.116g/mol
Formal Charge:
0
Heavy Atom Count:
20
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
262.327g/mol
Monoisotopic Mass:
262.116g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
0A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.8
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