5-Methyl-2-hexanoneoxime - ≥97%(mixture of isomers) , CAS No.624-44-2

CAS: 624-44-2 Cat. No.: M158557 분자식: C₇H₁₅NO 분자량: 129.2

GRADE & PURITY ≥97%(mixture of isomers)

Synonyms

SCHEMBL250665 | N-hydroxy-5-methyl-2-hexanimine | CID 12212 | DTXSID9060786 | AKOS017263165 | 5-Methylhexan-2-one oxime | FT-0632628 | CHEBI:131376 | N-(5-methylhexan-2-ylidene)hydroxylamine | D91366 | (E)-5-methylhexan-2-one oxime | 5-Methyl-2-hexanone o

Storage

Protected from light,Store at -20°C,Argon charged

Shipped In

Ice chest + Ice pads

Specifications

동의어

SCHEMBL250665 | N-hydroxy-5-methyl-2-hexanimine | CID 12212 | DTXSID9060786 | AKOS017263165 | 5-Methylhexan-2-one oxime | FT-0632628 | CHEBI:131376 | N-(5-methylhexan-2-ylidene)hydroxylamine | D91366 | (E)-5-methylhexan-2-one oxime | 5-Methyl-2-hexanone o

사양 및 순도

≥97%(mixture of isomers)

보관 조건

Protected from light,Store at -20°C,Argon charged

배송

Ice chest + Ice pads

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순수함

≥97%(mixture of isomers)

이름과 식별자

• 정식 스마일: CC(C)CCC(=NO)C
• IUPAC Name: N-(5-methylhexan-2-ylidene)hydroxylamine
• InChIKey: ZVZUNLVAVHYXNI-UHFFFAOYSA-N
• INCHI: 1S/C7H15NO/c1-6(2)4-5-7(3)8-9/h6,9H,4-5H2,1-3H3
• 이성체 SMILES: CC(C)CCC(=NO)C
• RTECS: MP4025000
• 분자량: 129.2
• Reaxy-Rn: 1700740
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1700740&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • 분류 Organonitrogen compounds
      • Subclass Oximes

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• 분류: Organonitrogen compounds
• Subclass: Oximes
• Intermediate Tree Nodes: Not available
• Direct Parent: Ketoximes
• Alternative Parents: Organopnictogen compounds Organic oxygen compounds Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Ketoxime - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Aliphatic acyclic compound
• 설명: This compound belongs to the class of organic compounds known as ketoximes. These are organic compounds with the general formula RC(R')=NOH (R,R' = organyl).
• 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

• 분자량: 129.199 g/mol
• XLogP3: 1.800
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 129.115 Da
• Monoisotopic Mass: 129.115 Da
• Topological Polar Surface Area: 32.600 Ų
• Heavy Atom Count: 9
• Formal Charge: 0
• Complexity: 97.100
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 0
• Undefined Bond Stereocenter Count: 1
• The total count of all stereochemical bonds: 1
• Covalently-Bonded Unit Count: 1

자주 묻는 질문

How is this product shipped?

This product ships in an insulated container with ice pads. Unpack on arrival and transfer it to the storage condition stated above.

What is the isomeric composition of this product?

This product is supplied at ≥97%, mixture of isomers. Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at ?20 °C, protected from light, under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 624-44-2, the molecular formula is C7H15NO, and the molecular weight is 129.2 g/mol. InChIKey ZVZUNLVAVHYXNI-UHFFFAOYSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.