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Home > Fluorides > 137814-07-4
137814-07-4 | Benzo[b]thiophene, 3,3'-(3,3,4,4,5,5-hexafluoro-1-cyclopentene-1,2-diyl)bis[2-methyl-
CAS No: 137814-07-4 Catalog No: AG0013W7 MDL No:MFCD06656279
Product Description
Catalog Number:
AG0013W7
Chemical Name:
Benzo[b]thiophene, 3,3'-(3,3,4,4,5,5-hexafluoro-1-cyclopentene-1,2-diyl)bis[2-methyl-
CAS Number:
137814-07-4
Molecular Formula:
C23H14F6S2
Molecular Weight:
468.4777
MDL Number:
MFCD06656279
IUPAC Name:
3-[3,3,4,4,5,5-hexafluoro-2-(2-methyl-1-benzothiophen-3-yl)cyclopenten-1-yl]-2-methyl-1-benzothiophene
InChI:
InChI=1S/C23H14F6S2/c1-11-17(13-7-3-5-9-15(13)30-11)19-20(22(26,27)23(28,29)21(19,24)25)18-12(2)31-16-10-6-4-8-14(16)18/h3-10H,1-2H3
InChI Key:
CNLMHUFAXSWHFA-UHFFFAOYSA-N
SMILES:
Cc1sc2c(c1C1=C(c3c(C)sc4c3cccc4)C(C(C1(F)F)(F)F)(F)F)cccc2
Properties
Complexity:
705
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
468.044g/mol
Formal Charge:
0
Heavy Atom Count:
31
Hydrogen Bond Acceptor Count:
8
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
468.475g/mol
Monoisotopic Mass:
468.044g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
56.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.6
Literature
| Title | Journal |
|---|---|
| In situ preparation of highly fluorescent dyes upon photoirradiation. | Journal of the American Chemical Society 20110831 |
| New thermally irreversible and fluorescent photochromic diarylethenes. | The journal of physical chemistry. A 20080529 |
| Ring closure reaction dynamics of diarylethene derivatives in solution. | The journal of physical chemistry. A 20070920 |
| Fatigue-resistant photochromic dithienylethenes by controlling the oxidation state. | Chemical communications (Cambridge, England) 20060507 |
| Effect of imino nitroxyl and nitronyl nitroxyl groups on the photochromic reactivity of diarylethenes. | Organic letters 20050818 |
| Highly fluorescent photochromic diarylethene in the closed-ring form. | Chemical communications (Cambridge, England) 20050521 |
| Modulation of the absorption, fluorescence, and liquid-crystal properties of functionalised diarylethene derivatives. | Chemistry (Weinheim an der Bergstrasse, Germany) 20041011 |
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