Propyne - ≥99% , CAS No.74-99-7

CAS: 74-99-7 Cat. No.: P465512 分子式: C₃H₄ 分子量: 40.06 EC番号: 200-828-4

グレード＆純度 ≥99%

Synonyms

DTXSID0026387 | 4-01-00-00958 (Beilstein Handbook Reference) | Methyl-d3-acetylene | DTXCID406387 | Q3407647 | P2152 | Methyl acetylene | InChI=1/C3H4/c1-3-2/h1H,2H | J-802281 | AKOS009104530 | Allylene | Propyne, >=99% | CCRIS 6830 | 1-PROPYNE [HSDB] | P

Storage

Room temperature

仕様

同義語

DTXSID0026387 | 4-01-00-00958 (Beilstein Handbook Reference) | Methyl-d3-acetylene | DTXCID406387 | Q3407647 | P2152 | Methyl acetylene | InChI=1/C3H4/c1-3-2/h1H,2H | J-802281 | AKOS009104530 | Allylene | Propyne, >=99% | CCRIS 6830 | 1-PROPYNE [HSDB] | P

仕様と純度

≥99%

保管条件

Room temperature

純度

≥99%

名前と識別子

カノニカル・スマイル

CC#C

IUPAC Name

prop-1-yne

InChIKey

MWWATHDPGQKSAR-UHFFFAOYSA-N

INCHI

1S/C3H4/c1-3-2/h1H,2H3

異性体SMILES

CC#C

UN番号

3161

分子量

40.06

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Acetylides

• Kingdom: Organic compounds
• Superclass: Acetylides
• 分類: Not available
• Subclass: Not available
• Intermediate Tree Nodes: Not available
• Direct Parent: Acetylides
• Alternative Parents: Terminal alkynes Unsaturated aliphatic hydrocarbons
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Acetylide - Monosubstituted alkyne - Unsaturated aliphatic hydrocarbon - Unsaturated hydrocarbon - Alkyne - Acyclic acetylene - Acetylene - Hydrocarbon - Aliphatic acyclic compound
• 説明: This compound belongs to the class of organic compounds known as acetylides. These are compounds arising by replacement of one or both hydrogen atoms of acetylene (ethyne) by a metal or other cationic group. E.g. NaC#CH monosodium acetylide. By extension, analogous compounds derived from terminal acetylenes, RC#CH. The class is limited here to derivatives of acetylene where the hydrogen atom is replaced with an element with similar or lower electronegativity that carbon.
• External Descriptors: terminal acetylenic compound - alkyne

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

作用メカニズム

化学的性質と物理的性質

• 分子量: 40.060 g/mol
• XLogP3: 0.900
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 40.0313 Da
• Monoisotopic Mass: 40.0313 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 3
• Formal Charge: 0
• Complexity: 26.500
• 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

よくある質問

What is the purity of this product?

This product is supplied at ≥99% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature.

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

The CAS Number is 74-99-7, the molecular formula is C3H4, and the molecular weight is 40.06 g/mol. InChIKey MWWATHDPGQKSAR-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.