Methanol-d4 - ≥99.8 atom% D , CAS No.811-98-3

CAS: 811-98-3 Cat. No.: M102262 분자식: CD₃OD 분자량: 36.07 Beilstein Registry Number: 1733278 EC 번호: 212-378-6

등급 & 순도 ≥99.8 atom% D

Synonyms

((2)H3)methan((2)H)ol|Propyleneoxide|((2)H4)methanol|Deuterated methanol|METHANOL (D4)|HCFC-22|Methanol D4|Methyl-d3 alcohol d|Carbonic chloride|CHI3|Methyl-d3 alcohol-d, cont. 0.03 v/v% TMS|(2H4)Methanol|Methanol-d4|Methan-d3-ol-d|methyl-d3 alcohol-d|trideuterio deuteriooxy methane|Perdeuteromethanol|Tetradeuteromethanol|MeNO2|Methyl Alcohol-d4|trideuterio(deuteriooxy)methane|Halocarbon 23

Storage

Protected from light,Room temperature,Argon charged,Desiccated

Shipped In

Normal

개요

Methanol-d4 can be used as a solvent in nuclear magnetic resonance spectroscopy analysis for the characterization of phenolic compounds separated from olive oil using high-performance liquid chromatography. Through the biotransformation of red yeast, vanillic acid and 4-hydroxy-3-methoxystyrene are formed.

사양

동의어

((2)H3)methan((2)H)ol | Propyleneoxide | ((2)H4)methanol | Deuterated methanol | METHANOL (D4) | HCFC-22 | Methanol D4 | Methyl-d3 alcohol d | Carbonic chloride | CHI3 | Methyl-d3 alcohol-d, cont. 0.03 v/v% TMS | (2H4)Methanol | Methanol-d4 | Methan-d3-ol-d | methyl-d3 alcohol-d | trideuterio deuteriooxy methane | Perdeuteromethanol | Tet Show more

사양 및 순도

≥99.8 atom% D

보관 조건

Protected from light,Room temperature,Argon charged,Desiccated

배송

Normal

순수함

≥99.8 atom% D

이름과 식별자

Pubchem Sid

508813885

정식 스마일

CO

IUPAC Name

trideuterio(deuteriooxy)methane

InChIKey

OKKJLVBELUTLKV-MZCSYVLQSA-N

INCHI

1S/CH4O/c1-2/h2H,1H3/i1D3,2D

이성체 SMILES

[2H]OC([2H])([2H])[2H]

WGK 독일

1

대체 CAS

67-56-1（Unlabeled）

UN 번호

UN1230

포장 그룹

II

분자량

36.07

Beilstein

1733278

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic oxygen compounds
    • 분류 Organooxygen compounds
      • Subclass Alcohols and polyols

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• 분류: Organooxygen compounds
• Subclass: Alcohols and polyols
• Intermediate Tree Nodes: Not available
• Direct Parent: Primary alcohols
• Alternative Parents: Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Hydrocarbon derivative - Primary alcohol - Aliphatic acyclic compound
• 설명: This compound belongs to the class of organic compounds known as primary alcohols. These are compounds comprising the primary alcohol functional group, with the general structure RCOH (R=alkyl, aryl).
• 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

• 용해성: It is miscible in water, ethanol, ether, acetone and chloroform.
• 감도: Light and Moisture sensitive
• 굴절률: 1.326
• 발화점(°F): 51.8 °F
• 발화점(°C): 11°C
• 끓는점(°C): 65.4°C
• 녹는점(°C): -98°C
• 분자량: 36.066 g/mol
• XLogP3: -0.500
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 36.0513 Da
• Monoisotopic Mass: 36.0513 Da
• Topological Polar Surface Area: 20.200 Ų
• Heavy Atom Count: 2
• Formal Charge: 0
• Complexity: 2.000
• Isotope Atom Count: 4
• 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