Heptadecane - Standard for GC, ≥99.5%(GC) , CAS No.629-78-7

CAS: 629-78-7 Cat. No.: H104720 분자식: C₁₇H₃₆ 분자량: 240.47 Beilstein Registry Number: 1738898 EC 번호: 211-108-4

GRADE & PURITY Standard for GC, ≥99.5%(GC)

Synonyms

CAS-629-78-7 | NSC 172782 | Heptadecane; NSC 172782; TS 7; n-Heptadecane | HSDB 8347 | C01816 | Heptadecane purum | n-Heptadecane (d36) | Normal-heptadecane | AI3-36898 | DTXCID5027061 | Heptadecane, 99% | Heptadecane, purum, >=98.0% (GC) | Samarium(III)C

Storage

Room temperature

Shipped In

Normal

Specifications

동의어

CAS-629-78-7 | NSC 172782 | Heptadecane; NSC 172782; TS 7; n-Heptadecane | HSDB 8347 | C01816 | Heptadecane purum | n-Heptadecane (d36) | Normal-heptadecane | AI3-36898 | DTXCID5027061 | Heptadecane, 99% | Heptadecane, purum, >=98.0% (GC) | Samarium(III)C

사양 및 순도

Standard for GC, ≥99.5%(GC)

보관 조건

Room temperature

배송

Normal

등급

Standard for GC

순수함

≥99.5%(GC)

이름과 식별자

Pubchem Sid

528770199

정식 스마일

CCCCCCCCCCCCCCCCC

IUPAC Name

heptadecane

InChIKey

NDJKXXJCMXVBJW-UHFFFAOYSA-N

INCHI

1S/C17H36/c1-3-5-7-9-11-13-15-17-16-14-12-10-8-6-4-2/h3-17H2,1-2H3

이성체 SMILES

CCCCCCCCCCCCCCCCC

WGK 독일

3

RTECS

MI3550000

분자량

240.47

Beilstein

1738898

Reaxy-Rn

1738898

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1738898&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: a small molecule

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: 1.4369
• 발화점(°F): 298.4℉
• 발화점(°C): 148℃
• 끓는점(°C): 301.8°C
• 녹는점(°C): 22°C
• 분자량: 240.500 g/mol
• XLogP3: 8.800
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 14
• Exact Mass: 240.282 Da
• Monoisotopic Mass: 240.282 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 17
• Formal Charge: 0
• Complexity: 103.000
• 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