Trimethylamine N-Oxide Dihydrate - 10mM in DMSO , CAS No.62637-93-8

CAS: 62637-93-8 Cat. No.: T425177 Molecular Weight: 111.14 EC Number: 678-501-4 PubChem CID: 198430

GRADE & PURITY 10mM in DMSO

Synonyms

62637-93-8|Trimethylamine N-oxide dihydrate|trimethylamine oxide dihydrate|Trimethylamine-N-oxide dihydrate|Trimethylamine oxide, dihydrate|N,N-Dimethylmethanamine oxide, dihydrate|MFCD00149077|N,N-dimethylmethanamine oxide;dihydrate|C73WZ0186W|Trimethyla

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

Overview

Trimethylamine N-oxide (TMAO) is an amphiphilic osmolyte that can counteract the denaturing effects of urea, pressure, and ice and stabilize the proteins.
Reactant for: · C-H bond cleavage · Oxidation reactions (oxidant) · Decarbonylating agent for solvent-free reactions Trimethylamine N-oxide dihydrate can react with transition-metal carbonyl cluster compounds and activate CO displacement by converting CO ligands into carbon dioxide.

Specifications

Synonyms

62637-93-8 | Trimethylamine N-oxide dihydrate | trimethylamine oxide dihydrate | Trimethylamine-N-oxide dihydrate | Trimethylamine oxide, dihydrate | N, N-Dimethylmethanamine oxide, dihydrate | MFCD00149077 | N, N-dimethylmethanamine oxide;dihydrate | C73WZ0186W | Trimethyla

Specifications & Purity

10mM in DMSO

Storage

Store at -80°C

Shipped In

Dry ice packs + Cold packs

This product requires cold chain shipping. Ground and other economy services are not available.

Names and Identifiers

• Canonical Smiles: C[N+](C)(C)[O-].O.O
• IUPAC Name: N,N-dimethylmethanamine oxide;dihydrate
• InChIKey: PGFPZGKEDZGJQZ-UHFFFAOYSA-N
• INCHI: 1S/C3H9NO.2H2O/c1-4(2,3)5;;/h1-3H3;2*1H2
• Isomeric SMILES: C[N+](C)(C)[O-].O.O
• PubChem CID: 198430
• Molecular Weight: 111.14

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • Class Organonitrogen compounds
      • Subclass Aminoxides

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• Class: Organonitrogen compounds
• Subclass: Aminoxides
• Intermediate Tree Nodes: Not available
• Direct Parent: Trialkyl amine oxides
• Alternative Parents: Trisubstituted amine oxides and derivatives Organopnictogen compounds Organic oxides Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Trialkyl amine oxide - Trisubstituted n-oxide - N-oxide - Organic oxygen compound - Organopnictogen compound - Organic oxide - Hydrocarbon derivative - Aliphatic acyclic compound
• Description: This compound belongs to the class of organic compounds known as trialkyl amine oxides. These are hydrocarbyl derivatives of the aminoxide anion, with the general formula R3N+[O-] or R3N=O, where R is an alkyl group.
• 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

Chemical and Physical Properties

• Sensitivity: Moisture sensitive
• Melt Point(°C): 96-101°C
• Molecular Weight: 111.140 g/mol
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 111.09 Da
• Monoisotopic Mass: 111.09 Da
• Topological Polar Surface Area: 20.100 Ų
• Heavy Atom Count: 7
• Formal Charge: 0
• Complexity: 28.400
• 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: 3

XLogP3

References

1. Lu Bai, Jing Dai, Yuxuan Xia, Kaichuan He, Hongmei Xue, Qi Guo, Danyang Tian, Lin Xiao, Xiangjian Zhang, Xu Teng, Yuming Wu, Sheng Jin.  (2022)  Hydrogen Sulfide Ameliorated High Choline-Induced Cardiac Dysfunction by Inhibiting cGAS-STING-NLRP3 Inflammasome Pathway.  Oxidative Medicine and Cellular Longevity,      [PMID:35910846] [10.1155/2022/1392896]

2. Jun Zhang, Jiang-ping Tu, Gao-hui Du, Zi-min Dong, Yi-shan Wu, Ling Chang, Dong Xie, Guo-fa Cai, Xiu-li Wang.  (2013)  Ultra-thin WO3 nanorod embedded polyaniline composite thin film: Synthesis and electrochromic characteristics.  SOLAR ENERGY MATERIALS AND SOLAR CELLS,      [PMID:] [10.1016/j.solmat.2013.02.025]

3. Yuming Huang, Lin Liu, Hang Yang, Huixuan Yi, Xiangyu Li, Linqian Li, Dawei Lu, Qian Liu, Guibin Jiang.  (2024)  Endogenous formation of Fe-bearing particles and their differentiation from exogenous exposure.  Journal of Environmental Sciences,      [PMID:] [10.1016/j.jes.2024.11.008]

4. Xiaoyun Yang, Yi Wang, Yujin Feng, Feng Wang, Lijuan Gao, Yueheng Wang.  (2025)  Trimethylamine oxide promotes myocardial fibrosis through activating JAK2-STAT3 pathway.  BIOCHEMICAL AND BIOPHYSICAL RESEARCH COMMUNICATIONS,      [PMID:39889626] [10.1016/j.bbrc.2025.151390]