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Home > Fluorides > 1443333-25-2
1443333-25-2 | 3-(4-n-Butoxy-3,5-difluorophenyl)-1-propene
CAS No: 1443333-25-2 Catalog No: AG01FB0A MDL No:
Product Description
Catalog Number:
AG01FB0A
Chemical Name:
3-(4-n-Butoxy-3,5-difluorophenyl)-1-propene
CAS Number:
1443333-25-2
Molecular Formula:
C13H16F2O
Molecular Weight:
226.2623
IUPAC Name:
2-butoxy-1,3-difluoro-5-prop-2-enylbenzene
InChI:
InChI=1S/C13H16F2O/c1-3-5-7-16-13-11(14)8-10(6-4-2)9-12(13)15/h4,8-9H,2-3,5-7H2,1H3
InChI Key:
PKAJEIPZTOLYBP-UHFFFAOYSA-N
SMILES:
CCCCOc1c(F)cc(cc1F)CC=C
Properties
Complexity:
196
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.117g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
226.267g/mol
Monoisotopic Mass:
226.117g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
9.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.4
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