2,4-Dimethyl-2-pentene - ≥98% , CAS No.625-65-0

CAS: 625-65-0 Cat. No.: D155423 분자식: C₇H₁₄ 분자량: 98.19 Beilstein Registry Number: 1(4)872 EC 번호: 210-905-4

GRADE & PURITY ≥98%

Synonyms

DTXSID70211545 | InChI=1/C7H14/c1-6(2)5-7(3)4/h5-6H,1-4H | 2-Pentene, 2,4-dimethyl- | D1254 | (CH3)2CHCH=C(CH3)2 | 2,4-DIMETHYL-2-PENTENE | AKOS024420962 | CHEBI:88412 | HR4J7V2RTJ | 2,4-dimethyl-3-pentene | EN300-118981 | UNII-HR4J7V2RTJ | MFCD00026435 |

Storage

Store at 2-8°C

Shipped In

Wet ice

Specifications

동의어

DTXSID70211545 | InChI=1/C7H14/c1-6(2)5-7(3)4/h5-6H,1-4H | 2-Pentene, 2,4-dimethyl- | D1254 | (CH3)2CHCH=C(CH3)2 | 2,4-DIMETHYL-2-PENTENE | AKOS024420962 | CHEBI:88412 | HR4J7V2RTJ | 2,4-dimethyl-3-pentene | EN300-118981 | UNII-HR4J7V2RTJ | MFCD00026435 |

사양 및 순도

≥98%

보관 조건

Store at 2-8°C

배송

Wet ice

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순수함

≥98%

이름과 식별자

Pubchem Sid

504752290

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504752290

정식 스마일

CC(C)C=C(C)C

IUPAC Name

2,4-dimethylpent-2-ene

InChIKey

VVCFYASOGFVJFN-UHFFFAOYSA-N

INCHI

1S/C7H14/c1-6(2)5-7(3)4/h5-6H,1-4H3

이성체 SMILES

CC(C)C=C(C)C

분자량

98.19

Beilstein

1(4)872

Reaxy-Rn

1731841

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1731841&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Hydrocarbons
    • 분류 Unsaturated hydrocarbons
      • Subclass Branched unsaturated hydrocarbons

• Kingdom: Organic compounds
• Superclass: Hydrocarbons
• 분류: Unsaturated hydrocarbons
• Subclass: Branched unsaturated hydrocarbons
• Intermediate Tree Nodes: Not available
• Direct Parent: Branched unsaturated hydrocarbons
• Alternative Parents: Unsaturated aliphatic hydrocarbons Alkenes
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Branched unsaturated hydrocarbon - Unsaturated aliphatic hydrocarbon - Olefin - Alkene - Acyclic olefin - Aliphatic acyclic compound
• 설명: This compound belongs to the class of organic compounds known as branched unsaturated hydrocarbons. These are hydrocarbons that contains one or more unsaturated carbon atoms, and an aliphatic branch.
• 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

화학 및 물리적 특성

• 감도: Heat sensitive
• 굴절률: 1.40
• 발화점(°C): -9 °C
• 끓는점(°C): 83°C
• 녹는점(°C): -128 °C
• 분자량: 98.190 g/mol
• XLogP3: 3.100
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 1
• Exact Mass: 98.1096 Da
• Monoisotopic Mass: 98.1096 Da
• Topological Polar Surface Area: 0.000 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 64.099
• 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