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Home > Fluorides > 100444-41-5
100444-41-5 | Ethanone, 1-(4-decylphenyl)-2,2,2-trifluoro-
CAS No: 100444-41-5 Catalog No: AG00020E MDL No:MFCD00060688
Product Description
Catalog Number:
AG00020E
Chemical Name:
Ethanone, 1-(4-decylphenyl)-2,2,2-trifluoro-
CAS Number:
100444-41-5
Molecular Formula:
C18H25F3O
Molecular Weight:
314.3857
MDL Number:
MFCD00060688
IUPAC Name:
1-(4-decylphenyl)-2,2,2-trifluoroethanone
InChI:
InChI=1S/C18H25F3O/c1-2-3-4-5-6-7-8-9-10-15-11-13-16(14-12-15)17(22)18(19,20)21/h11-14H,2-10H2,1H3
InChI Key:
GJNWUVBDBVUZKP-UHFFFAOYSA-N
SMILES:
CCCCCCCCCCc1ccc(cc1)C(=O)C(F)(F)F
Properties
Complexity:
304
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
314.186g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
314.392g/mol
Monoisotopic Mass:
314.186g/mol
Rotatable Bond Count:
10
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.9
Literature
| Title | Journal |
|---|---|
| A lipophilic sol-gel matrix for the development of a carbonate-selective electrode. | Analytical chemistry 20041015 |
| Determination of oceanic carbon dioxide using a carbonate-selective electrode. | Analytical chemistry 20020515 |
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