5-phenylthiazole - ≥97% , CAS No.1826-13-7

CAS: 1826-13-7 Cat. No.: P630805 Summenformel: C₉H₇NS Molekulargewicht: 161.22 PubChem CID: 595209

GRADE & PURITY ≥97%

Synonyms

FT-0653717 | 5-Phenyl-1,3-thiazole # | 5-phenyl-1,3-thiazole, 34 | DS-17853 | DTXSID30344227 | Thiazole, 5-phenyl- | SCHEMBL48894 | InChI=1/C9H7NS/c1-2-4-8(5-3-1)9-6-10-7-11-9/h1-7 | BDBM24682 | 5-phenylthiazole | O11489 | MFCD12911591 | A812711 | AKOS015

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications

Synonyme

FT-0653717 | 5-Phenyl-1,3-thiazole # | 5-phenyl-1,3-thiazole, 34 | DS-17853 | DTXSID30344227 | Thiazole, 5-phenyl- | SCHEMBL48894 | InChI=1/C9H7NS/c1-2-4-8(5-3-1)9-6-10-7-11-9/h1-7 | BDBM24682 | 5-phenylthiazole | O11489 | MFCD12911591 | A812711 | AKOS015

Spezifikationen & Reinheit

≥97%

Storage

Store at 2-8°C

Verschickt in

Wet ice

Dieses Produkt erfordert Kühlkettenversand. Grundversand und andere Economy-Optionen sind nicht verfügbar.

Reinheit

≥97%

Namen und Kennungen

• Kanonisches Lächeln: C1=CC=C(C=C1)C2=CN=CS2
• IUPAC Name: 5-phenyl-1,3-thiazole
• InChIKey: ZLLOWHFKKIOINR-UHFFFAOYSA-N
• INCHI: 1S/C9H7NS/c1-2-4-8(5-3-1)9-6-10-7-11-9/h1-7H
• Isomere SMILES: C1=CC=C(C=C1)C2=CN=CS2
• Alternative CAS-Nummer: 1826-13-7
• PubChem CID: 595209
• Molekulargewicht: 161.22

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Benzenoids
    • Klasse Benzene and substituted derivatives

• Kingdom: Organic compounds
• Superclass: Benzenoids
• Klasse: Benzene and substituted derivatives
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Benzene and substituted derivatives
• Alternative Parents: Thiazoles Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Monocyclic benzene moiety - Heteroaromatic compound - Thiazole - Azole - Azacycle - Organoheterocyclic compound - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteromonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as benzene and substituted derivatives. These are aromatic compounds containing one monocyclic ring system consisting of benzene.
• External Descriptors: Not available

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

Wirkungsmechanismen

Chemische und physikalische Eigenschaften

• Molekulargewicht: 161.230 g/mol
• XLogP3: 2.600
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 161.03 Da
• Monoisotopic Mass: 161.03 Da
• Topological Polar Surface Area: 41.100 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 121.000
• 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 ≥97% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at 2–8 °C. Refrigerated storage is required to maintain the specified shelf life.

How is this product shipped?

This product ships chilled on wet ice. Unpack on arrival and transfer it to the storage condition stated above.

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

The CAS Number is 1826-13-7, the molecular formula is C9H7NS, and the molecular weight is 161.22 g/mol. InChIKey ZLLOWHFKKIOINR-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.