2-Bromoethanol-1,1,2,2-d4

Base Information

• Chemical Name: 2-Bromoethanol-1,1,2,2-d4
• CAS No.: 81764-55-8
• Molecular Formula: C2HBrD4O
• Molecular Weight: 128.933
• European Community (EC) Number: 688-569-7
• DSSTox Substance ID: DTXSID50493928
• Nikkaji Number: J3.027.968I
• Wikidata: Q72455234
• Mol file: 81764-55-8.mol

Synonyms:2-Bromoethanol-1,1,2,2-d4;81764-55-8;Bromoethanol-D4;2-bromo-1,1,2,2-tetradeuterioethanol;2-Bromoethanol-d4;Ethylene-d4 bromohydrin;2-Bromo(~2~H_4_)ethan-1-ol;Deuterated 2-bromoethanol;SCHEMBL877195;DTXSID50493928;2-bromoethan-1,1,2,2-d4-1-ol;AKOS015913000;HY-150535S;CS-0534418;2-Bromoethanol-1,1,2,2-d4, 98 atom % D;D98257

Chemical Property of 2-Bromoethanol-1,1,2,2-d4

Chemical Property:

• Refractive Index: n20/D 1.493(lit.)
• Boiling Point: 136.2 °C at 760 mmHg
• Flash Point: 57.1 °C
• PSA: 20.23000
• Density: 1.785 g/cm³
• LogP: 0.37360
• Storage Temp.: -20°C
• XLogP3: 0.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 127.97748
• Heavy Atom Count: 4
• Complexity: 10

Purity/Quality:

NLT 98% ^*data from raw suppliers

2-Bromoethanol-d4 ^*data from reagent suppliers

Safty Information:

• Pictogram(s): T
• Hazard Codes: T+
• Statements: 26/27/28-34-40
• Safety Statements: 23-36/37/39-45

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(CBr)O
• Isomeric SMILES: [2H]C([2H])(C([2H])([2H])Br)O
• Uses: 2-BROMOETHANOL-1,1,2,2-D4 is an widely used intermediate in organic synthesis.