1,7-Dioxaspiro[5.5]undecane - ≥97% , CAS No.180-84-7

CAS: 180-84-7 Cat. No.: D464235 분자식: C₉H₁₆O₂ 분자량: 156.22

GRADE & PURITY ≥97%

Synonyms

CAS-180-84-7 | 1,7-Dioxaspiro[5.5]undecane | AS-59233 | EINECS 205-870-7 | CHEBI:195752 | (S)-1,7-Dioxaspiro[5.5]undecane | 1,7-Dioxaspiro[5.5]undecane, >=97% | LMPK09000012 | Eco-Trap | MFCD00011578 | 1,7-dioxaspiro[5,5]undecane | 1,7-Dioxaspiro[5.5]unde

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications

동의어

CAS-180-84-7 | 1,7-Dioxaspiro[5.5]undecane | AS-59233 | EINECS 205-870-7 | CHEBI:195752 | (S)-1,7-Dioxaspiro[5.5]undecane | 1,7-Dioxaspiro[5.5]undecane, >=97% | LMPK09000012 | Eco-Trap | MFCD00011578 | 1,7-dioxaspiro[5,5]undecane | 1,7-Dioxaspiro[5.5]unde

사양 및 순도

≥97%

생화학 및 생리적 메커니즘

Pheromone forDacus oleae

보관 조건

Store at 2-8°C

배송

Wet ice

이 제품은 콜드 체인 배송이 필요합니다.지상 및 기타 경제 서비스는 사용할 수 없습니다.

순수함

≥97%

이름과 식별자

Pubchem Sid

528753891

정식 스마일

C1CCOC2(C1)CCCCO2

IUPAC Name

1,7-dioxaspiro[5.5]undecane

InChIKey

GBBVHDGKDQAEOT-UHFFFAOYSA-N

INCHI

1S/C9H16O2/c1-3-7-10-9(5-1)6-2-4-8-11-9/h1-8H2

이성체 SMILES

C1CCOC2(C1)CCCCO2

WGK 독일

3

분자량

156.22

Reaxy-Rn

105997

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=105997&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • 분류 Organooxygen compounds
      • Subclass Ethers
        • Level5 Acetals
          • Level6 Ketals

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• 분류: Organooxygen compounds
• Subclass: Ethers
• Intermediate Tree Nodes: Acetals
• Direct Parent: Ketals
• Alternative Parents: Oxanes Oxacyclic compounds Hydrocarbon derivatives
• Molecular Framework: Aliphatic heteropolycyclic compounds
• Substituents: Ketal - Oxane - Oxacycle - Organoheterocyclic compound - Hydrocarbon derivative - Aliphatic heteropolycyclic compound
• 설명: This compound belongs to the class of organic compounds known as ketals. These are acetals derived from ketones by replacement of the oxo group by two hydrocarbyloxy groups R2C(OR)2 ( R not Hydrogen ). This term, once abandoned, has been reinstated as a subclass of acetals.
• External Descriptors: Polyether polyketides

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

• 발화점(°F): 147.2 °F
• 발화점(°C): 64 °C
• 끓는점(°C): 193°C
• 분자량: 156.220 g/mol
• XLogP3: 1.600
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 156.115 Da
• Monoisotopic Mass: 156.115 Da
• Topological Polar Surface Area: 18.500 Ų
• Heavy Atom Count: 11
• Formal Charge: 0
• Complexity: 118.000
• 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