(4-chlorothiophen-2-yl)methanol - ≥97% , CAS No.233280-30-3

CAS: 233280-30-3 Cat. No.: C175832 Summenformel: C₅H₅ClOS Molekulargewicht: 148.6 EG-Nummer: 828-544-1

GRADE & PURITY ≥97%

Synonyms

ZITLTSGBFHFCOG-UHFFFAOYSA-N | SCHEMBL1768865 | MFCD17016116 | FT-0747210 | 2-Thiophenemethanol, 4-chloro- | EN300-1655833 | NS-01134 | (4-chloro-thiophen-2-yl)methanol | (4-chlorothiophen-2-yl)methanol | AKOS017516373 | PB24317 | 4-CHLOROTHIOPHENE-2-METHA

Storage

Room temperature

Shipped In

Normal

Specifications

Synonyme

ZITLTSGBFHFCOG-UHFFFAOYSA-N | SCHEMBL1768865 | MFCD17016116 | FT-0747210 | 2-Thiophenemethanol, 4-chloro- | EN300-1655833 | NS-01134 | (4-chloro-thiophen-2-yl)methanol | (4-chlorothiophen-2-yl)methanol | AKOS017516373 | PB24317 | 4-CHLOROTHIOPHENE-2-METHA

Spezifikationen & Reinheit

≥97%

Storage

Room temperature

Verschickt in

Normal

Reinheit

≥97%

Namen und Kennungen

• Kanonisches Lächeln: C1=C(SC=C1Cl)CO
• IUPAC Name: (4-chlorothiophen-2-yl)methanol
• InChIKey: ZITLTSGBFHFCOG-UHFFFAOYSA-N
• INCHI: 1S/C5H5ClOS/c6-4-1-5(2-7)8-3-4/h1,3,7H,2H2
• Isomere SMILES: C1=C(SC=C1Cl)CO
• Molekulargewicht: 148.6
• Reaxy-Rn: 21502708
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=21502708&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organohalogen compounds
    • Klasse Aryl halides
      • Subclass Aryl chlorides

• Kingdom: Organic compounds
• Superclass: Organohalogen compounds
• Klasse: Aryl halides
• Subclass: Aryl chlorides
• Intermediate Tree Nodes: Not available
• Direct Parent: Aryl chlorides
• Alternative Parents: Thiophenes Heteroaromatic compounds Primary alcohols Organochlorides Hydrocarbon derivatives Aromatic alcohols
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Aryl chloride - Heteroaromatic compound - Thiophene - Organoheterocyclic compound - Organic oxygen compound - Hydrocarbon derivative - Aromatic alcohol - Primary alcohol - Organooxygen compound - Organochloride - Alcohol - Aromatic heteromonocyclic compound
• Beschreibung: This compound belongs to the class of organic compounds known as aryl chlorides. These are organic compounds containing the acyl chloride functional group.
• 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

Chemische und physikalische Eigenschaften

• Molekulargewicht: 148.610 g/mol
• XLogP3: 1.400
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 147.975 Da
• Monoisotopic Mass: 147.975 Da
• Topological Polar Surface Area: 48.500 Ų
• Heavy Atom Count: 8
• Formal Charge: 0
• Complexity: 78.800
• 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 ≥97% 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 233280-30-3, the molecular formula is C5H5ClOS, and the molecular weight is 148.6 g/mol. InChIKey ZITLTSGBFHFCOG-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.