2-Metiltiazol - ≥98% , CAS No.3581-87-1

CAS: 3581-87-1 Cat. No.: M299351 Fórmula: C₄H₅NS Peso molecular: 99.15 Número CE: 222-702-8

GRADE & PURITY ≥98%

Synonyms

AM20090566 | Thiazole, methyl- | 2-Methyl-1,3-thiazole # | EINECS 222-702-8 | UNII-7G081N1ERP | 2-Methyl-1,3-thiazole | EN300-36818 | Thiazole, 2-methyl- | Q-100427 | SY009541 | A822986 | MFCD00053144 | 2-Methyl-1,3-thiazole, AldrichCPR | FT-0601077 | AKO

Storage

Room temperature

Shipped In

Normal

Specifications

Sinónimos

AM20090566 | Thiazole, methyl- | 2-Methyl-1,3-thiazole # | EINECS 222-702-8 | UNII-7G081N1ERP | 2-Methyl-1,3-thiazole | EN300-36818 | Thiazole, 2-methyl- | Q-100427 | SY009541 | A822986 | MFCD00053144 | 2-Methyl-1,3-thiazole, AldrichCPR | FT-0601077 | AKO

Especificações e pureza

≥98%

Condições de armazenamento de armazenamento

Room temperature

Enviado em

Normal

Pureza

≥98%

Nomes e identificadores

Pubchem Sid

504755148

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504755148

Sorrisos canónicos

CC1=NC=CS1

IUPAC Name

2-methyl-1,3-thiazole

InChIKey

VZWOXDYRBDIHMA-UHFFFAOYSA-N

INCHI

1S/C4H5NS/c1-4-5-2-3-6-4/h2-3H,1H3

SMILES isoméricas

CC1=NC=CS1

Número UN

1993

Grupo de embalagem

III

Peso molecular

99.15

Reaxy-Rn

1369

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1369&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Classe Azoles
      • Subclass Thiazoles

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Classe: Azoles
• Subclass: Thiazoles
• Intermediate Tree Nodes: Not available
• Direct Parent: Thiazoles
• Alternative Parents: Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Organonitrogen compounds Hydrocarbon derivatives
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Heteroaromatic compound - Thiazole - Azacycle - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Organonitrogen compound - Aromatic heteromonocyclic compound
• Descrição: This compound belongs to the class of organic compounds known as thiazoles. These are heterocyclic compounds containing a five-member aromatic ring made up of one sulfur atom, one nitrogen, and three carbon atoms.
• 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

Propriedades químicas e físicas

• Índice de refração: 1.5190 to 1.5230
• Ponto de ebulição (°C): 129 °C
• Ponto de fusão (°C): -24°C
• Peso molecular: 99.160 g/mol
• XLogP3: 1.400
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 99.0143 Da
• Monoisotopic Mass: 99.0143 Da
• Topological Polar Surface Area: 41.100 Ų
• Heavy Atom Count: 6
• Formal Charge: 0
• Complexity: 46.800
• 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

Perguntas frequentes

What is the purity of this product?

This product is supplied at ≥98% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

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

The CAS Number is 3581-87-1, the molecular formula is C4H5NS, and the molecular weight is 99.15 g/mol. InChIKey VZWOXDYRBDIHMA-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.