4,4'-(Thiophene-2,5-diyl)dibenzonitrile
Product Information
Molecular Formula
C18H10N2S
Molecular Weight
286.35
IUPAC Name
4-[5-(4-cyanophenyl)thiophen-2-yl]benzonitrile
SMILES
C1=CC(=CC=C1C#N)C2=CC=C(S2)C3=CC=C(C=C3)C#N
InChI
InChI=1S/C18H10N2S/c19-11-13-1-5-15(6-2-13)17-9-10-18(21-17)16-7-3-14(12-20)4-8-16/h1-10H
InChI Key
HKDJGRLOXRXWOF-UHFFFAOYSA-N
Purity
98%
Computed Properties
XLogP3
4.4
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
2
Exact Mass
286.0564695
Monoisotopic Mass
286.0564695
Topological Polar Surface Area
75.8
Heavy Atom Count
21
Formal Charge
0
Complexity
398
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes
Patents
| Publication Number | Title | Priority Date |
|---|---|---|
| CN-113912844-A | Triazine ring connection-based aromatic two-dimensional organic framework nano material and preparation method thereof | 2021-10-21 |
| CA-2832149-A1 | Photochromic and electrochromic diarylcyclopentene derivatives | 2011-09-30 |
| CA-2832149-C | Photochromic and electrochromic diarylcyclopentene derivatives | 2011-09-30 |
| CN-103890133-A | Switching materials, and compositions and methods for making same | 2011-09-30 |
| EP-2760969-A1 | Photochromic and electrochromic diarylcyclopentene derivatives as optical filters | 2011-09-30 |
| KR-20190124800-A | Diarylethene compounds and uses thereof | 2011-09-30 |
| US-10072023-B2 | Diarylethene compounds and uses thereof | 2011-09-30 |
| US-10556912-B2 | Diarylethene compounds and uses thereof | 2011-09-30 |
| US-2018339995-A1 | Photochromic and electrochromic diarylcyclopentene derivatives as optical filters | 2011-09-30 |
| US-2019256526-A1 | Diarylethene compounds and uses thereof | 2011-09-30 |
