(2E)-hexadecenal - ≥99% , CAS No.3163-37-9

CAS: 3163-37-9 Cat. No.: E130542 분자식: C₁₆H₃₀O 분자량: 238.41

GRADE & PURITY ≥99%

Synonyms

(E)-2-hexadecenal|2-Hexadecenal|Hexadecenal|(E)-hexadec-2-enal|(2E)-hexadecenal|22644-96-8|3163-37-9|trans-2-Hexadecenal|hexadec-2-enal|2-trans-Hexadecenal|trans-hexadec-2-enal|(2E)-hexadec-2-enal|27104-14-9|Z79H35Z0RU|UNII-Z79H35Z0RU|2-hexadecenal, E|2-(

Storage

Room temperature

Shipped In

Normal

Application

228,229

Specifications

동의어

(E)-2-hexadecenal | 2-Hexadecenal | Hexadecenal | (E)-hexadec-2-enal | (2E)-hexadecenal | 22644-96-8 | 3163-37-9 | trans-2-Hexadecenal | hexadec-2-enal | 2-trans-Hexadecenal | trans-hexadec-2-enal | (2E)-hexadec-2-enal | 27104-14-9 | Z79H35Z0RU | UNII-Z79H35Z0RU | 2-hexadecenal, E | 2-(

사양 및 순도

≥99%

보관 조건

Room temperature

배송

Normal

순수함

≥99%

이름과 식별자

• 정식 스마일: CCCCCCCCCCCCCC=CC=O
• IUPAC Name: (E)-hexadec-2-enal
• InChIKey: KLJFYXOVGVXZKT-CCEZHUSRSA-N
• INCHI: 1S/C16H30O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17/h14-16H,2-13H2,1H3/b15-14+
• 이성체 SMILES: CCCCCCCCCCCCC/C=C/C=O
• 분자량: 238.41
• Reaxy-Rn: 2254840
• Reaxys-RN_link_address: https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2254840&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Lipids and lipid-like molecules
    • 분류 Fatty Acyls
      • Subclass Fatty aldehydes

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• 분류: Fatty Acyls
• Subclass: Fatty aldehydes
• Intermediate Tree Nodes: Not available
• Direct Parent: Fatty aldehydes
• Alternative Parents: Enals Organic oxides Hydrocarbon derivatives Aldehydes
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Fatty aldehyde - Enal - Alpha,beta-unsaturated aldehyde - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aldehyde - Aliphatic acyclic compound
• 설명: This compound belongs to the class of organic compounds known as fatty aldehydes. These are long chain aldehydes with a chain of at least 12 carbon atoms.
• External Descriptors: Fatty aldehydes

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: 238.410 g/mol
• XLogP3: 6.900
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 13
• Exact Mass: 238.23 Da
• Monoisotopic Mass: 238.23 Da
• Topological Polar Surface Area: 17.100 Ų
• Heavy Atom Count: 17
• Formal Charge: 0
• Complexity: 172.000
• Isotope Atom Count: 0
• Defined Atom Stereocenter Count: 0
• Undefined Atom Stereocenter Count: 0
• Defined Bond Stereocenter Count: 1
• Undefined Bond Stereocenter Count: 0
• The total count of all stereochemical bonds: 1
• Covalently-Bonded Unit Count: 1

자주 묻는 질문

What is the purity of this product?

This product is supplied at ≥99% purity (chemical assay). Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at room temperature.

How is this product shipped?

This product ships under standard ambient conditions. No temperature-controlled packaging is required.

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

The CAS Number is 3163-37-9, the molecular formula is C16H30O, and the molecular weight is 238.41 g/mol. InChIKey KLJFYXOVGVXZKT-CCEZHUSRSA-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.