Thiophene - ≥99% , CAS No.110-02-1

CAS: 110-02-1 Cat. No.: T108259 Summenformel: C₄H₄S Molekulargewicht: 84.14 Beilstein Registry Number: 103222 EG-Nummer: 203-729-4 PubChem CID: 8030

GRADE & PURITY ≥99%

Synonyms

CP 34 | NSC 405073 | Divinylene sulphide | Thiophene, Reagent | DTXCID006145 | THIOPHENE-2,5-D2 | EN300-19105 | Thiofuran | thio-furan | Thiophene, >=99% | NSC405073 | NSC-405073 | A802128 | Huile H50 | 2-Thiophene | BRN 0103222 | UN 2414 | Q-100055 | Thi

Storage

Room temperature,Argon charged

Shipped In

FedEx DG Service

Specifications

Synonyme

CP 34 | NSC 405073 | Divinylene sulphide | Thiophene, Reagent | DTXCID006145 | THIOPHENE-2,5-D2 | EN300-19105 | Thiofuran | thio-furan | Thiophene, >=99% | NSC405073 | NSC-405073 | A802128 | Huile H50 | 2-Thiophene | BRN 0103222 | UN 2414 | Q-100055 | Thi

Spezifikationen & Reinheit

≥99%

Storage

Room temperature,Argon charged

Verschickt in

FedEx DG Service

Reinheit

≥99%

Namen und Kennungen

Pubchem Sid

488180658

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488180658

Kanonisches Lächeln

C1=CSC=C1

IUPAC Name

thiophene

InChIKey

YTPLMLYBLZKORZ-UHFFFAOYSA-N

INCHI

1S/C4H4S/c1-2-4-5-3-1/h1-4H

Isomere SMILES

C1=CSC=C1

WGK Deutschland

3

PubChem CID

8030

UN-Nummer

2414

Verpackungsgruppe

II

Molekulargewicht

84.14

Beilstein

103222

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Klasse Heteroaromatic compounds

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Klasse: Heteroaromatic compounds
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Heteroaromatic compounds
• Alternative Parents: Thiophenes Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Heteroaromatic compound - Thiophene - Hydrocarbon derivative - Aromatic heteromonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as heteroaromatic compounds. These are compounds containing an aromatic ring where a carbon atom is linked to an hetero atom.
• External Descriptors: thiophenes - mancude organic heteromonocyclic parent - monocyclic heteroarene

Data sources

1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.

DOI: 10.1186/s13321-016-0174-y

Zugehörige Ziele (menschlich)

NR3C1 Tclin Glucocorticoid receptor (14987 Activities)

Discover Target: NR3C1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

VDR Tclin Vitamin D receptor (26531 Activities)

Discover Target: VDR

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

TBXAS1 Tchem Thromboxane-A synthase (3355 Activities)

Discover Target: TBXAS1

Activity Type	Relation	Activity value	Units	Action Type	Journal	PubMed Id	doi	Assay Aladdin ID

Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Löslichkeit: Miscible with ethyl alcohol, diethyl ether and other organic solvents. Immiscible with water.
• Empfindlichkeit: air sensitive
• Brechungsindex: 1.529
• Flammpunkt (°F): 30.2 °F
• Flammpunkt (°C): -1℃
• Siedepunkt (°C): 84.2°C
• Schmelzpunkt (°C): －38.2°C
• Molekulargewicht: 84.140 g/mol
• XLogP3: 1.800
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 84.0034 Da
• Monoisotopic Mass: 84.0034 Da
• Topological Polar Surface Area: 28.200 Ų
• Heavy Atom Count: 5
• Formal Charge: 0
• Complexity: 22.800
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 0
• Covalently-Bonded Unit Count: 1

Häufig gestellte Fragen

What is the purity of this product?

This product is supplied at ≥99% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product is classified as dangerous goods and ships via FedEx DG Service. Ground and other economy services are not available, and delivery to some destinations or address types may be restricted.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 110-02-1, the molecular formula is C4H4S, and the molecular weight is 84.14 g/mol. InChIKey YTPLMLYBLZKORZ-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.