Tetrahydropyran - Anhydrous Grade, ≥99% , CAS No.142-68-7

CAS: 142-68-7 Cat. No.: T298966 Molecular Weight: 86.13 Beilstein Registry Number: 102436 EC Number: 205-552-8 PubChem CID: 8894

GRADE & PURITY Anhydrous Grade, ≥99%

Synonyms

AMY8873 | H11250 | TETRAHYDROPYRAN | tetrahydro-pyran | 2H-Pyran, tetrahydro- | CHEBI:46941 | PYE | Tetrahydro-2H-pyran | EINECS 205-552-8 | DTXSID3059719 | NSC65448 | Tetrahydropyran, anhydrous, 99% | TETRAHYDROPYRAN [MI] | MFCD00006585 | HSDB 126 | Oxac

Storage

Room temperature

Shipped In

FedEx DG Service

Specifications

Synonyms

AMY8873 | H11250 | TETRAHYDROPYRAN | tetrahydro-pyran | 2H-Pyran, tetrahydro- | CHEBI:46941 | PYE | Tetrahydro-2H-pyran | EINECS 205-552-8 | DTXSID3059719 | NSC65448 | Tetrahydropyran, anhydrous, 99% | TETRAHYDROPYRAN [MI] | MFCD00006585 | HSDB 126 | Oxac

Specifications & Purity

Anhydrous Grade, ≥99%

Storage

Room temperature

Shipped In

FedEx DG Service

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

Grade

Anhydrous Grade

Purity

≥99%

Names and Identifiers

• Canonical Smiles: C1CCOCC1
• IUPAC Name: oxane
• InChIKey: DHXVGJBLRPWPCS-UHFFFAOYSA-N
• INCHI: 1S/C5H10O/c1-2-4-6-5-3-1/h1-5H2
• Isomeric SMILES: C1CCOCC1
• WGK Germany: 3
• PubChem CID: 8894
• UN Number: 1993
• Molecular Weight: 86.13
• Beilstein: 102436
• Reaxy-Rn: 102436

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organoheterocyclic compounds
    • Class Oxanes

• Kingdom: Organic compounds
• Superclass: Organoheterocyclic compounds
• Class: Oxanes
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Oxanes
• Alternative Parents: Oxacyclic compounds Dialkyl ethers Hydrocarbon derivatives
• Molecular Framework: Aliphatic heteromonocyclic compounds
• Substituents: Oxane - Oxacycle - Ether - Dialkyl ether - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aliphatic heteromonocyclic compound
• Description: This compound belongs to the class of organic compounds known as oxanes. These are compounds containing an oxane (tetrahydropyran) ring, which is a six-member saturated aliphatic heterocycle with one oxygen atom and five carbon atoms.
• External Descriptors: saturated organic heteromonocyclic parent - oxanes

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

• Refractive Index: 1.4195
• Flash Point(°F): 3.2 °F
• Flash Point(°C): -15℃
• Boil Point(°C): 88°C
• Melt Point(°C): -45°C
• Molecular Weight: 86.130 g/mol
• XLogP3: 0.900
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 86.0732 Da
• Monoisotopic Mass: 86.0732 Da
• Topological Polar Surface Area: 9.200 Ų
• Heavy Atom Count: 6
• Formal Charge: 0
• Complexity: 30.900
• 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

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