2-Bromoethanol-1,1,2,2-d4 - ≥98 atom% D , CAS No.81764-55-8

CAS: 81764-55-8 Cat. No.: B136478 Formula: BrCD₂CD₂OH Peso molecolare: 128.99 Numero EC: 688-569-7

QUALITÀ & PUREZZA ≥98 atom% D

Synonyms

SCHEMBL877195 | DTXSID50493928 | 2-bromo-1,1,2,2-tetradeuterioethanol | AKOS015913000 | HY-150535S | Ethylene-d4 bromohydrin | D98257 | 2-Bromoethanol-1,1,2,2-d4, 98 atom % D | Bromoethanol-D4 | Deuterated 2-bromoethanol | 2-Bromoethanol-1,1,2,2-d4 | 2-Br

Storage

Store at 2-8°C,Argon charged

Shipped In

Wet ice

Specifiche

Sinonimi

SCHEMBL877195 | DTXSID50493928 | 2-bromo-1,1,2,2-tetradeuterioethanol | AKOS015913000 | HY-150535S | Ethylene-d4 bromohydrin | D98257 | 2-Bromoethanol-1,1,2,2-d4, 98 atom % D | Bromoethanol-D4 | Deuterated 2-bromoethanol | 2-Bromoethanol-1,1,2,2-d4 | 2-Br

Specifiche e purezza

≥98 atom% D

Condizioni di conservazione di stoccaggio

Store at 2-8°C,Argon charged

Spedito in

Wet ice

Questo prodotto richiede spedizione a catena fredda. I servizi di terra e altri servizi economici non sono disponibili.

Purezza

≥98 atom% D

Nomi e identificatori

Pubchem Sid

508808371

Sorrisi canonici

C(CBr)O

IUPAC Name

2-bromo-1,1,2,2-tetradeuterioethanol

InChIKey

LDLCZOVUSADOIV-LNLMKGTHSA-N

INCHI

1S/C2H5BrO/c3-1-2-4/h4H,1-2H2/i1D2,2D2

Isomeri SMILES

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

WGK Germania

3

Numero UN

2922

Gruppo di imballaggio

II

Peso molecolare

128.99

Reaxy-Rn

878140

Reaxys-RN_link_address

https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=878140&ln=

Taxonomic Classification

Taxonomy Tree

• Kingdom Organic compounds
  • Superclass Organohalogen compounds
    • Classe Halohydrins
      • Subclass Bromohydrins

• Kingdom: Organic compounds
• Superclass: Organohalogen compounds
• Classe: Halohydrins
• Subclass: Bromohydrins
• Intermediate Tree Nodes: Not available
• Direct Parent: Bromohydrins
• Alternative Parents: Primary alcohols Organobromides Hydrocarbon derivatives Alkyl bromides
• Molecular Framework: Aliphatic acyclic compounds
• Substituents: Bromohydrin - Organic oxygen compound - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Organobromide - Alkyl halide - Alkyl bromide - Alcohol - Aliphatic acyclic compound
• Descrizione: This compound belongs to the class of organic compounds known as bromohydrins. These are alcohols substituted by a bromine atom at a saturated carbon atom otherwise bearing only hydrogen or hydrocarbyl groups.
• 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: 1.493
• Punto di infiammabilità (°F): 235.4 °F
• Punto di infiammabilità (°C): 113 °C
• Punto di ebollizione (°C): 56-57 °C/20 mmHg
• Peso molecolare: 128.990 g/mol
• XLogP3: 0.200
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 127.977 Da
• Monoisotopic Mass: 127.977 Da
• Topological Polar Surface Area: 20.200 Ų
• Heavy Atom Count: 4
• Formal Charge: 0
• Complexity: 10.000
• 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

Domande frequenti

What is the isotopic enrichment of this product?

This product is isotopically enriched to ≥98 atom% deuterium. Isotopic enrichment is a separate specification from chemical purity — a labelled compound has both. Lot-specific values are stated on the Certificate of Analysis.

How should this product be stored?

Store at 2–8 °C under argon. It is supplied under an argon blanket; reseal under inert gas after each use.

How is this product shipped?

This product ships chilled on wet ice. Unpack on arrival and transfer it to the storage condition stated above.

What are the CAS number, molecular formula and molecular weight?

The CAS Number is 81764-55-8, the molecular formula is BrCD2CD2OH, and the molecular weight is 128.99 g/mol. InChIKey LDLCZOVUSADOIV-LNLMKGTHSA-N.

What documentation is provided?

Available product documentation, including Certificates of Analysis (COA), Safety Data Sheets (SDS), and specification sheets, is shown in the product document area. Document availability and access follow the current site policy.