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Home > Fluorides > 842123-81-3
842123-81-3 | 4-(3-Fluoro-4-methoxyphenyl)-1-buten-4-ol
CAS No: 842123-81-3 Catalog No: AG01EXME MDL No:
Product Description
Catalog Number:
AG01EXME
Chemical Name:
4-(3-Fluoro-4-methoxyphenyl)-1-buten-4-ol
CAS Number:
842123-81-3
Molecular Formula:
C11H13FO2
Molecular Weight:
196.2181
IUPAC Name:
1-(3-fluoro-4-methoxyphenyl)but-3-en-1-ol
InChI:
InChI=1S/C11H13FO2/c1-3-4-10(13)8-5-6-11(14-2)9(12)7-8/h3,5-7,10,13H,1,4H2,2H3
InChI Key:
LICJOUKQRNVEPI-UHFFFAOYSA-N
SMILES:
C=CCC(c1ccc(c(c1)F)OC)O
Properties
Complexity:
184
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.09g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
196.221g/mol
Monoisotopic Mass:
196.09g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
29.5A^2
Undefined Atom Stereocenter Count:
1
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
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