Name: 3-ethynyloxolane - ≥97% , CAS No.1100987-19-6
SKU: E626866
Availability: InStock

Taxonomic Classification

Taxonomy Tree

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
分類	Oxolanes
Subclass	Not available
Intermediate Tree Nodes	Not available
Direct Parent	Oxolanes
Alternative Parents	Oxacyclic compounds Dialkyl ethers Acetylides Hydrocarbon derivatives
Molecular Framework	Aliphatic heteromonocyclic compounds
Substituents	Oxolane - Acetylide - Oxacycle - Ether - Dialkyl ether - Organic oxygen compound - Hydrocarbon derivative - Organooxygen compound - Aliphatic heteromonocyclic compound
説明	This compound belongs to the class of organic compounds known as oxolanes. These are organic compounds containing an oxolane (tetrahydrofuran) ring, which is a saturated aliphatic five-member ring containing one oxygen and five carbon atoms.
External Descriptors	Not available
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

3 D構造

証明書（CoA、COO、BSE/TSEと分析図）

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

化学的性質と物理的性質

分子量	96.130 g/mol
XLogP3	0.600
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	1
Rotatable Bond Count	0
Exact Mass	96.0575 Da
Monoisotopic Mass	96.0575 Da
Topological Polar Surface Area	9.200 Å²
Heavy Atom Count	7
Formal Charge	0
Complexity	98.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
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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レビュー

カノニカル・スマイル	C#CC1CCOC1
IUPAC Name	3-ethynyloxolane
InChIKey	YHAJZHXJKUOHJZ-UHFFFAOYSA-N
INCHI	1S/C6H8O/c1-2-6-3-4-7-5-6/h1,6H,3-5H2
異性体SMILES	C#CC1CCOC1
代替CAS番号	1100987-19-6
PubChem CID	22594387
分子量	96.13

3-ethynyloxolane - ≥97% , CAS No.1100987-19-6

Specifications