Nonacosane - ≥99% , CAS No.630-03-5

CAS: 630-03-5 Cat. No.: N111740 분자식: C₂₉H₆₀ 분자량: 408.79 Beilstein Registry Number: 1724922 EC 번호: 211-126-2

등급 & 순도 ≥99%

Synonyms

Nonacosane, analytical standard | UNII-IGL1697BK1 | Nonacosane; Celidoniol, deoxy- (7CI); n-Nonacosane | AI3-36284 | CH3-(CH2)27-CH3 | N-BOC-4-NITRO-L-PHENYLALANINE-T-BUTYLESTER | CHEBI:7613 | DTXCID8043602 | EINECS 211-126-2 | DC7C60EC-A78D-4260-BEE6-924

Storage

Room temperature

Shipped In

Normal

개요

product description：

Nonacosane is a major paraffin of most plant waxes.The metabolic fate of n-nonacosane (from cabbage wax) in Micrococcus cerificans, a soil organism has been investigated. Solubility of solid n-nonacosane in supercritical ethane has been reported.

사양

동의어

Nonacosane, analytical standard | UNII-IGL1697BK1 | Nonacosane; Celidoniol, deoxy- (7CI); n-Nonacosane | AI3-36284 | CH3-(CH2)27-CH3 | N-BOC-4-NITRO-L-PHENYLALANINE-T-BUTYLESTER | CHEBI:7613 | DTXCID8043602 | EINECS 211-126-2 | DC7C60EC-A78D-4260-BEE6-924

사양 및 순도

≥99%

보관 조건

Room temperature

배송

Normal

순수함

≥99%

이름과 식별자

Pubchem Sid

488181664

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488181664

정식 스마일

CCCCCCCCCCCCCCCCCCCCCCCCCCCCC

IUPAC Name

nonacosane

InChIKey

IGGUPRCHHJZPBS-UHFFFAOYSA-N

INCHI

1S/C29H60/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h3-29H2,1-2H3

이성체 SMILES

CCCCCCCCCCCCCCCCCCCCCCCCCCCCC

WGK 독일

3

UN 번호

1325

분자량

408.79

Beilstein

1724922

Reaxy-Rn

1724922

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1724922&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Hydrocarbons
    • 분류 Saturated hydrocarbons
      • Subclass Alkanes

• Kingdom: Organic compounds
• Superclass: Hydrocarbons
• 분류: Saturated hydrocarbons
• Subclass: Alkanes
• Intermediate Tree Nodes: Not available
• Direct Parent: Alkanes
• Alternative Parents: Not available
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Acyclic alkane - Alkane - Aliphatic acyclic compound
• 설명: This compound belongs to the class of organic compounds known as alkanes. These are acyclic branched or unbranched hydrocarbons having the general formula CnH2n+2 , and therefore consisting entirely of hydrogen atoms and saturated carbon atoms.
• External Descriptors: an alkane

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

작용 메커니즘

화학 및 물리적 특성

• 용해성: Solubility in Toluene almost transparency
• 끓는점(°C): 286°C
• 녹는점(°C): 63-66°C
• 분자량: 408.800 g/mol
• XLogP3: 15.300
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 26
• Exact Mass: 408.47 Da
• Monoisotopic Mass: 408.47 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 29
• Formal Charge: 0
• Complexity: 231.000
• 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