α-Terthiophene - CAS 1081-34-1
Catalog: |
BB002176 |
Product Name: |
α-Terthiophene |
CAS: |
1081-34-1 |
Synonyms: |
alpha-Terthienyl; 2,2':5',2''-Terthiophene; 2,5-Di(2-thienyl)thiophene |
Application: |
2,2':5',2''-Terthiophene is a thiophene compound isolated from the roots of Echinops transiliensis, and was studied for its larvicidal activity against Aedes aegypti. 2,2':5',2''-Terthiophene also showed inhibitory effects on dispersal ability of Bursaphelenchus xylophilus when used synergistically with certain antibiotics. |
IUPAC Name: | 2,5-dithiophen-2-ylthiophene |
Description: | α-Terthiophene is a natural compound with antibacterial and antioxidant properties. |
Molecular Weight: | 248.4 |
Molecular Formula: | C12H8S3 |
Canonical SMILES: | C1=CSC(=C1)C2=CC=C(S2)C3=CC=CS3 |
InChI: | InChI=1S/C12H8S3/c1-3-9(13-7-1)11-5-6-12(15-11)10-4-2-8-14-10/h1-8H |
InChI Key: | KXSFECAJUBPPFE-UHFFFAOYSA-N |
Boiling Point: | 160 °C (0.1 mmHg) |
Melting Point: | 95 °C |
Purity: | 98 % |
Density: | 1.318 g/cm3 |
Solubility: | Slightly soluble in Methanol, Ethanol;soluble in Ether, Benzene, Acetone |
Appearance: | Powder |
Storage: | Keep in dark place. |
MDL: | MFCD00012167 |
LogP: | 5.20510 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113354475-A | Method for improving fertility level of agaricus bisporus mushroom dregs | 20210714 |
CN-113150253-A | Thiopyranone-based high-molecular compound and preparation method and application thereof | 20210507 |
CN-112592465-A | Osmium-containing heteropentadiyne conjugated polymer with main chain and preparation method and application thereof | 20201106 |
CN-112250677-A | Organic small molecule hole transport material based on spiro [ fluorene-9, 9' -xanthene ], preparation method and application thereof | 20201016 |
CN-112175871-A | Marigold flower and fresh flower compound leavening agent and application thereof | 20201012 |
PMID | Publication Date | Title | Journal |
28506552 | 20170625 | The natural terthiophene α-terthienylmethanol induces S phase cell cycle arrest of human ovarian cancer cells via the generation of ROS stress | Chemico-biological interactions |
28364798 | 20170401 | Antioxidative cellular response of lepidopteran ovarian cells to photoactivated alpha-terthienyl | Pesticide biochemistry and physiology |
27999363 | 20161219 | Neurotoxicity of a Biopesticide Analog on Zebrafish Larvae at Nanomolar Concentrations | International journal of molecular sciences |
23016599 | 20121023 | Directed growth of mixed self-assembled monolayers on a nanostructured template: a step toward the patterning of functional molecular domains | Langmuir : the ACS journal of surfaces and colloids |
22825618 | 20120723 | Solid-state synthesis of poly(3',4'-dimethoxy-2,2':5',2'- terthiophene): comparison with poly(terthiophene) and poly(3',4'-ethylenedioxy-2,2':5',2'- terthiophene) | Molecules (Basel, Switzerland) |
Complexity: | 197 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 247.97881378 |
Formal Charge: | 0 |
Heavy Atom Count: | 15 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 247.97881378 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 84.7 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.4 |
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