Valeric Acid-d9 - ≥98 atom% D,≥98% , CAS No.115871-50-6

CAS: 115871-50-6 Cat. No.: V302252 分子式: CD₃(CD₂)₃CO₂H 分子量: 111.19 EC番号: 693-241-1

GRADE & PURITY ≥98 atom% D,≥98%

Synonyms

A935643 | J-003329 | 2,2,3,3,4,4,5,5,5-nonadeuteriopentanoic acid | Pentanoic-d9 acid | D99088 | Valeric-d9 acid | (~2~H_9_)Pentanoic acid | SCHEMBL7937405 | Valeric Acid-d9 | DTXSID60672929 | Pentanoic Acid-d9 | (?H?)pentanoic acid | pentanoic-d9 | Valer

Storage

Store at 2-8°C,Protected from light

Shipped In

Wet ice

概要

Product Application:

Valeric Acid-d9 is the isotope labelled analog of Valeric Acid which is used in biological studies of (D)-b-hydroxybutyrate which inhibits adipocyte lipolysis via the nicotinic acid receptor PUMA-G.

Specifications

同義語

A935643 | J-003329 | 2,2,3,3,4,4,5,5,5-nonadeuteriopentanoic acid | Pentanoic-d9 acid | D99088 | Valeric-d9 acid | (~2~H_9_)Pentanoic acid | SCHEMBL7937405 | Valeric Acid-d9 | DTXSID60672929 | Pentanoic Acid-d9 | (?H?)pentanoic acid | pentanoic-d9 | Valer

仕様と純度

≥98 atom% D,≥98%

保管条件

Store at 2-8°C,Protected from light

入荷

Wet ice

この製品は冷冷この冷このこの製品の運送が必要です。地上およびその他の経済サービスは利用できません。

アクションタイプ

ACTIVATOR

純度

≥98 atom% D,≥98%

名前と識別子

パブケム・シド

504770662

パブケム・シド・ウル

https://pubchem.ncbi.nlm.nih.gov/substance/504770662

カノニカル・スマイル

CCCCC(=O)O

IUPAC Name

2,2,3,3,4,4,5,5,5-nonadeuteriopentanoic acid

InChIKey

NQPDZGIKBAWPEJ-YNSOAAEFSA-N

INCHI

1S/C5H10O2/c1-2-3-4-5(6)7/h2-4H2,1H3,(H,6,7)/i1D3,2D2,3D2,4D2

異性体SMILES

[2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])C(=O)O

代替CAS番号

109-52-4（unlabeled）

分子量

111.19

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Lipids and lipid-like molecules
    • 分類 Fatty Acyls
      • Subclass Fatty acids and conjugates

• Kingdom: Organic compounds
• Superclass: Lipids and lipid-like molecules
• 分類: Fatty Acyls
• Subclass: Fatty acids and conjugates
• Intermediate Tree Nodes: Not available
• Direct Parent: Straight chain fatty acids
• Alternative Parents: Monocarboxylic acids and derivatives Carboxylic acids Organic oxides Hydrocarbon derivatives Carbonyl compounds
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Straight chain fatty acid - Monocarboxylic acid or derivatives - Carboxylic acid - Carboxylic acid derivative - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Carbonyl group - Aliphatic acyclic compound
• 説明: This compound belongs to the class of organic compounds known as straight chain fatty acids. These are fatty acids with a straight aliphatic chain.
• 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

化学的性質と物理的性質

• 溶解度: Chloroform (Sparingly), Ethyl Acetate (Slightly). Methanol (Slightly)
• 感度: Moisture and light sensitive
• 屈折率: n20/D 1.4076 (lit.)
• 引火点（°C）: 12.2°C
• 沸点（°C）: 103.7°C at 760 mmHg
• 融点（°C）: -20-18 °C (lit.)
• 分子量: 111.190 g/mol
• XLogP3: 1.400
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 111.125 Da
• Monoisotopic Mass: 111.125 Da
• Topological Polar Surface Area: 37.300 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 59.100
• Isotope Atom Count: 9
• 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