BIS-TRIS(Bis-Tris) - UltraBio™, Ultra pure, ≥98%(T) , CAS No.6976-37-0

CAS: 6976-37-0 Cat. No.: B433342 分子式: C₈H₁₉NO₅ 分子量: 209.24 Beilstein Registry Number: 2205275 EC番号: 686-880-2

グレード＆純度 UltraBio™, Ultra pure, ≥98%(T)

Synonyms

1,3-Propanediol, 2-[bis(2-hydroxyethyl)amino]-2-(hydroxymethyl)- | 2-[bis(2-hydroxyethyl)amino]-2-(hydroxymethyl)propane-1,3-diol | Bis(2-hydroxyethyl)iminotris(hydroxymethyl)methane BIS-TRIS | Bistris; NSC 119932; NSC 24868; NuPage Bis-Tris | NSC24868 |

Storage

Room temperature

概要

Other Notes

Easily compare specifications for BIS-TRIS products with the BIS-TRIS specification table .

仕様

同義語

1,3-Propanediol, 2-[bis(2-hydroxyethyl)amino]-2-(hydroxymethyl)- | 2-[bis(2-hydroxyethyl)amino]-2-(hydroxymethyl)propane-1,3-diol | Bis(2-hydroxyethyl)iminotris(hydroxymethyl)methane BIS-TRIS | Bistris; NSC 119932; NSC 24868; NuPage Bis-Tris | NSC24868 |

仕様と純度

UltraBio™, Ultra pure, ≥98%(T)

保管条件

Room temperature

等級

Ultra pure, UltraBio™

純度

≥98%(T)

名前と識別子

カノニカル・スマイル

C(CO)N(CCO)C(CO)(CO)CO

IUPAC Name

2-[bis(2-hydroxyethyl)amino]-2-(hydroxymethyl)propane-1,3-diol

InChIKey

OWMVSZAMULFTJU-UHFFFAOYSA-N

INCHI

1S/C8H19NO5/c10-3-1-9(2-4-11)8(5-12,6-13)7-14/h10-14H,1-7H2

異性体SMILES

C(CO)N(CCO)C(CO)(CO)CO

WGKドイツ

3

分子量

209.24

Beilstein

2205275

Reaxy-Rn

2205275

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=2205275&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organic nitrogen compounds
    • 分類 Organonitrogen compounds
      • Subclass Amines
        • Level5 Alkanolamines
          • Level6 1,2-aminoalcohols

• Kingdom: Organic compounds
• Superclass: Organic nitrogen compounds
• 分類: Organonitrogen compounds
• Subclass: Amines
• Intermediate Tree Nodes: Alkanolamines
• Direct Parent: 1,2-aminoalcohols
• Alternative Parents: Trialkylamines Primary alcohols Organopnictogen compounds Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Tertiary aliphatic amine - Tertiary amine - 1,2-aminoalcohol - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Alcohol - Aliphatic acyclic compound
• 説明: This compound belongs to the class of organic compounds known as 1,2-aminoalcohols. These are organic compounds containing an alkyl chain with an amine group bound to the C1 atom and an alcohol group bound to the C2 atom.
• External Descriptors: pentol

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: H2O: 1M, clear, colorless
• 融点（°C）: 103-104°C
• 分子量: 209.240 g/mol
• XLogP3: -3.300
• Hydrogen Bond Donor Count: 5
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 8
• Exact Mass: 209.126 Da
• Monoisotopic Mass: 209.126 Da
• Topological Polar Surface Area: 104.000 Ų
• Heavy Atom Count: 14
• Formal Charge: 0
• Complexity: 125.000
• 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: 1