Glycer(ol-d₃) - ≥98 atom% D,≥98% , CAS No.7325-16-8

CAS: 7325-16-8 Cat. No.: G474157 Formula: (DOCH₂)₂CHOD Peso molecolare: 95.11

GRADE & PURITY ≥98 atom% D,≥98%

Synonyms

1,2,3-trideuteriooxypropane | HY-B1659S8 | Propane-1,2,3-(~2~H_3_)triol | DTXSID80583528 | glycerol-d3 | Glycer(ol-d3), 99 atom % D | 1,2,3-Propanetriol-d3(9CI) | D98567 | Glycer(ol-d3)

Storage

Argon charged,Room temperature

Shipped In

Normal

Specifications

Sinonimi

1,2,3-trideuteriooxypropane | HY-B1659S8 | Propane-1,2,3-(~2~H_3_)triol | DTXSID80583528 | glycerol-d3 | Glycer(ol-d3), 99 atom % D | 1,2,3-Propanetriol-d3(9CI) | D98567 | Glycer(ol-d3)

Specifiche e purezza

≥98 atom% D,≥98%

Condizioni di conservazione di stoccaggio

Argon charged,Room temperature

Spedito in

Normal

Purezza

≥98 atom% D,≥98%

Nomi e identificatori

Pubchem Sid

504768148

Pubchem Sid Url

https://pubchem.ncbi.nlm.nih.gov/substance/504768148

Sorrisi canonici

C(C(CO)O)O

IUPAC Name

1,2,3-trideuteriooxypropane

InChIKey

PEDCQBHIVMGVHV-WVALGTIDSA-N

INCHI

1S/C3H8O3/c4-1-3(6)2-5/h3-6H,1-2H2/i4D,5D,6D

Isomeri SMILES

[2H]OCC(CO[2H])O[2H]

Peso molecolare

95.11

Reaxy-Rn

635685

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=635685&ln=

Taxonomic Classification

Taxonomy Tree

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

• Kingdom: Organic compounds
• Superclass: Organic oxygen compounds
• Classe: Organooxygen compounds
• Subclass: Alcohols and polyols
• Intermediate Tree Nodes: Not available
• Direct Parent: Secondary alcohols
• Alternative Parents: Primary alcohols Hydrocarbon derivatives
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Secondary alcohol - Hydrocarbon derivative - Primary alcohol - Aliphatic acyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as secondary alcohols. These are compounds containing a secondary alcohol functional group, with the general structure HOC(R)(R') (R,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

Proprietà chimiche e fisiche

• Sensibilità: Hygroscopic
• Indice di rifrazione: n20/D 1.4676 (lit.)
• Punto di infiammabilità (°F): 235.4 °F - closed cup
• Punto di infiammabilità (°C): 113 °C - closed cup
• Punto di ebollizione (°C): 182℃ (lit.)
• Punto di fusione (°C): 20℃ (lit.)
• Peso molecolare: 95.110 g/mol
• XLogP3: -1.800
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 95.0662 Da
• Monoisotopic Mass: 95.0662 Da
• Topological Polar Surface Area: 60.700 Ų
• Heavy Atom Count: 6
• Formal Charge: 0
• Complexity: 25.200
• Isotope Atom Count: 3
• 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