2-Thiophenemethanol - ≥98%(GC) , CAS No.636-72-6

CAS: 636-72-6 Cat. No.: T162809 Formula: C₅H₆OS Molecular Weight: 114.16 Beilstein Registry Number: 383595 EC Number: 211-264-3 PubChem CID: 69467

GRADE & PURITY ≥98%(GC)

Synonyms

SY036796 | 2-THIENYLCARBINOL | AM804174 | W-104889 | 2-Thienylmethanol | 2-Thiophenemethanol, 98% | EINECS 211-264-3 | Thenyl alcohol | PS-5570 | Thiophene, 2-(hydroxymethyl)- | (thiophen-2-yl)methanol | 2-Hydroxymethylthiophene | 2-hydroxymethyl-thiophen

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifications

Synonyms

SY036796 | 2-THIENYLCARBINOL | AM804174 | W-104889 | 2-Thienylmethanol | 2-Thiophenemethanol, 98% | EINECS 211-264-3 | Thenyl alcohol | PS-5570 | Thiophene, 2-(hydroxymethyl)- | (thiophen-2-yl)methanol | 2-Hydroxymethylthiophene | 2-hydroxymethyl-thiophen

Specifications & Purity

≥98%(GC)

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

This product requires cold chain shipping. Ground and other economy services are not available.

Purity

≥98%(GC)

Names and Identifiers

Pubchem Sid

504754397

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504754397

Canonical Smiles

C1=CSC(=C1)CO

IUPAC Name

thiophen-2-ylmethanol

InChIKey

ZPHGMBGIFODUMF-UHFFFAOYSA-N

INCHI

1S/C5H6OS/c6-4-5-2-1-3-7-5/h1-3,6H,4H2

Isomeric SMILES

C1=CSC(=C1)CO

WGK Germany

3

PubChem CID

69467

Molecular Weight

114.16

Beilstein

383595

Reaxy-Rn

383596

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Class Heteroaromatic compounds

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Class: Heteroaromatic compounds
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Heteroaromatic compounds
• Alternative Parents: Thiophenes Primary alcohols Hydrocarbon derivatives Aromatic alcohols
• Molecular Framework: Aromatic heteromonocyclic compounds
• Substituents: Heteroaromatic compound - Thiophene - Organic oxygen compound - Hydrocarbon derivative - Aromatic alcohol - Primary alcohol - Organooxygen compound - Alcohol - Aromatic heteromonocyclic compound
• Description: 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: 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

Chemical and Physical Properties

• Sensitivity: air sensitive
• Refractive Index: 1.563
• Flash Point(°F): 230°F
• Flash Point(°C): >110°C
• Boil Point(°C): 207°C
• Melt Point(°C): 0℃
• Molecular Weight: 114.170 g/mol
• XLogP3: 0.900
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 114.014 Da
• Monoisotopic Mass: 114.014 Da
• Topological Polar Surface Area: 48.500 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 56.000
• 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

Frequently Asked Questions

What is the purity of this product, and how is it determined?

This product is supplied at ≥98% purity, determined by gas chromatography (GC). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at 2–8 °C under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

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 636-72-6, the molecular formula is C5H6OS, and the molecular weight is 114.16 g/mol. InChIKey ZPHGMBGIFODUMF-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.