3-Octyn-1-ol - ≥98%(GC) , CAS No.14916-80-4

CAS: 14916-80-4 Cat. No.: O159921 Formula: C₈H₁₄O Peso molecolare: 126.2 Numero EC: 238-986-1

QUALITÀ & PUREZZA ≥98%(GC)

Synonyms

FT-0616290 | AI3-07044 | SY049758 | O0141 | MFCD00039552 | oct-3-yn-1-ol | 1-Hydroxyoctin-(3) | DTXSID8065828 | NSC 67251 | UNII-PJK55CL7Z5 | SCHEMBL487757 | D91816 | 3-octyne-1-ol | 3-Octyn-1-ol | A808855 | W-108091 | FS-4073 | NSC67251 | NSC-67251 | PJK

Storage

Store at 2-8°C

Shipped In

Wet ice

Panoramica

3-Octyn-1-ol may be used in the preparation of: · (3Z)-octen-1-ol · 7-octyn-1-ol · 3-cis-octenoic acid

Specifiche

Sinonimi

FT-0616290 | AI3-07044 | SY049758 | O0141 | MFCD00039552 | oct-3-yn-1-ol | 1-Hydroxyoctin-(3) | DTXSID8065828 | NSC 67251 | UNII-PJK55CL7Z5 | SCHEMBL487757 | D91816 | 3-octyne-1-ol | 3-Octyn-1-ol | A808855 | W-108091 | FS-4073 | NSC67251 | NSC-67251 | PJK

Specifiche e purezza

≥98%(GC)

Condizioni di conservazione di stoccaggio

Store at 2-8°C

Spedito in

Wet ice

Questo prodotto richiede spedizione a catena fredda. I servizi di terra e altri servizi economici non sono disponibili.

Purezza

≥98%(GC)

Nomi e identificatori

Pubchem Sid

508809103

Sorrisi canonici

CCCCC#CCCO

IUPAC Name

oct-3-yn-1-ol

InChIKey

LRZGRGVRZSDRTK-UHFFFAOYSA-N

INCHI

1S/C8H14O/c1-2-3-4-5-6-7-8-9/h9H,2-4,7-8H2,1H3

Isomeri SMILES

CCCCC#CCCO

WGK Germania

3

Peso molecolare

126.2

Reaxy-Rn

1739950

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1739950&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Lipids and lipid-like molecules
    • Classe Fatty Acyls
      • Subclass Fatty alcohols

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• Classe: Fatty Acyls
• Subclass: Fatty alcohols
• Intermediate Tree Nodes: Not available
• Direct Parent: Fatty alcohols
• Alternative Parents: Primary alcohols Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Fatty alcohol - Organic oxygen compound - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Alcohol - Aliphatic acyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as fatty alcohols. These are aliphatic alcohols consisting of a chain of a least six carbon atoms.
• 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

Proprietà chimiche e fisiche

• Indice di rifrazione: 1.45
• Punto di ebollizione (°C): 86-88℃/9mm
• Peso molecolare: 126.200 g/mol
• XLogP3: 2.100
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 126.104 Da
• Monoisotopic Mass: 126.104 Da
• Topological Polar Surface Area: 20.200 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 104.000
• 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