Cyclopentadecanol - ≥96%(GC) , CAS No.4727-17-7

CAS: 4727-17-7 Cat. No.: C154093 Formule: C₁₅H₃₀O Poids moléculaire: 226.4 Beilstein Registry Number: 6(4)185

QUALITÉ & PURETÉ ≥96%(GC)

Synonyms

AI3-37207 | DTXCID0040545 | DTXSID5063578 | Q27274159 | AX02BP4A5S | Normuscol | SY048869 | D89420 | EINECS 225-221-1 | Hydroxycyclopentadecane | UNII-AX02BP4A5S | MFCD00039425 | EXALTOL | AKOS024286277 | SCHEMBL811994 | Cyclopentadecan-1-ol | Cyclopentad

Storage

Room temperature,Desiccated

Shipped In

Normal

Spécifications

Synonymes

AI3-37207 | DTXCID0040545 | DTXSID5063578 | Q27274159 | AX02BP4A5S | Normuscol | SY048869 | D89420 | EINECS 225-221-1 | Hydroxycyclopentadecane | UNII-AX02BP4A5S | MFCD00039425 | EXALTOL | AKOS024286277 | SCHEMBL811994 | Cyclopentadecan-1-ol | Cyclopentad

Spécifications et pureté

≥96%(GC)

Conditions de stockage de stockage

Room temperature,Desiccated

Expédié en

Normal

Pureté

≥96%(GC)

Noms et identifiants

Pubchem Sid

504756612

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504756612

Sourires canoniques

C1CCCCCCCC(CCCCCC1)O

IUPAC Name

cyclopentadecanol

InChIKey

FFVHXGZXDRXFLQ-UHFFFAOYSA-N

INCHI

1S/C15H30O/c16-15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-15/h15-16H,1-14H2

Isomères SMILES

C1CCCCCCCC(CCCCCC1)O

Poids moléculaire

226.4

Beilstein

6(4)185

Reaxy-Rn

2076040

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2076040&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • Classe Organooxygen compounds
      • Subclass Alcohols and polyols

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Classe: Organooxygen compounds
• Subclass: Alcohols and polyols
• Intermediate Tree Nodes: Not available
• Direct Parent: Secondary alcohols
• Alternative Parents: Hydrocarbon derivatives
• Molecular Framework: Aliphatic homomonocyclic compounds
• Substituents: Secondary alcohol - Hydrocarbon derivative - Aliphatic homomonocyclic compound
• Description: This compound belongs to the class of organic compounds known as secondary alcohols. These are compounds containing a secondary alcohol functional group, with the general structure HOC(R)(R') (R,R'=alkyl, aryl).
• 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

Propriétés chimiques et physiques

• Point de fusion (°C): 85 °C
• Poids moléculaire: 226.400 g/mol
• XLogP3: 5.400
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 226.23 Da
• Monoisotopic Mass: 226.23 Da
• Topological Polar Surface Area: 20.200 Ų
• Heavy Atom Count: 16
• Formal Charge: 0
• Complexity: 128.000
• 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