2-Methylnonane - ≥95% , CAS No.871-83-0

CAS: 871-83-0 Cat. No.: M406711 분자식: C₁₀H₂₂ 분자량: 142.29 EC 번호: 212-814-5

등급 & 순도 ≥95%

Synonyms

2-METHYLNONANE|871-83-0|Nonane, 2-methyl-|2 - methylnonane|Octane, dimethyl-|68551-16-6|382AKH052V|NSC-24849|C9-11 Isoparaffin|63335-88-6|ISODECANE|EINECS 271-365-3|iso-decane|UNII-382AKH052V|2-methyl-nonane|EINECS 212-814-5|EINECS 252-052-0|NSC 24849|344

Storage

Room temperature

Shipped In

Normal

사양

동의어

2-METHYLNONANE | 871-83-0 | Nonane, 2-methyl- | 2 - methylnonane | Octane, dimethyl- | 68551-16-6 | 382AKH052V | NSC-24849 | C9-11 Isoparaffin | 63335-88-6 | ISODECANE | EINECS 271-365-3 | iso-decane | UNII-382AKH052V | 2-methyl-nonane | EINECS 212-814-5 | EINECS 252-052-0 | NSC 24849 | 344

사양 및 순도

≥95%

보관 조건

Room temperature

배송

Normal

순수함

≥95%

이름과 식별자

Pubchem Sid

488181839

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/488181839

정식 스마일

CCCCCCCC(C)C

IUPAC Name

2-methylnonane

InChIKey

SGVYKUFIHHTIFL-UHFFFAOYSA-N

INCHI

1S/C10H22/c1-4-5-6-7-8-9-10(2)3/h10H,4-9H2,1-3H3

이성체 SMILES

CCCCCCCC(C)C

WGK 독일

3

분자량

142.29

Reaxy-Rn

1696990

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1696990&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: Branched alkanes
• Alternative Parents: Not available
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Branched alkane - Aliphatic acyclic compound
• 설명: This compound belongs to the class of organic compounds known as branched alkanes. These are acyclic branched hydrocarbons having the general formula CnH2n+2.
• External Descriptors: Hydrocarbons

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

화학 및 물리적 특성

• 굴절률: 1.41
• 발화점(°F): 114.8 °F
• 발화점(°C): 46°C
• 끓는점(°C): 166-169 °C
• 분자량: 142.280 g/mol
• XLogP3: 5.300
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 6
• Exact Mass: 142.172 Da
• Monoisotopic Mass: 142.172 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 10
• Formal Charge: 0
• Complexity: 55.100
• 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