1-Bromotridecane-1,1,2,2-d4

Base Information

• Chemical Name: 1-Bromotridecane-1,1,2,2-d4
• CAS No.: 284474-45-9
• Molecular Formula: C13H23 Br D4
• Molecular Weight: 267.28
• European Community (EC) Number: 693-194-7
• DSSTox Substance ID: DTXSID90584001
• Wikidata: Q82475623
• Mol file: 284474-45-9.mol

Synonyms:1-Bromotridecane-1,1,2,2-d4;284474-45-9;1-Bromotridecane-d4;1-bromo-1,1,2,2-tetradeuteriotridecane;DTXSID90584001;HY-W110702S1;1-bromo(1,1,2,2-?H?)tridecane;1-Bromo(1,1,2,2-~2~H_4_)tridecane;CS-0608622;D99633;1-Bromotridecane-1,1,2,2-d4, 98 atom % D

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

Chemical Property:

• Melting Point: 4-7 °C(lit.)
• Refractive Index: n20/D 1.459(lit.)
• Boiling Point: 148-150 °C10 mm Hg(lit.)
• Flash Point: 110°C
• PSA: 0.00000
• Density: 1.046 g/mL at 25 °C
• LogP: 5.69230
• XLogP3: 7.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 11
• Exact Mass: 266.15472
• Heavy Atom Count: 14
• Complexity: 91.2

Purity/Quality:

99% ^*data from raw suppliers

1-Bromotridecane-1,1,2,2-d4 ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi,Xn
• Statements: 36/37/38-41-37/38-22
• Safety Statements: 26-36-39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCCCCCCCCBr
• Isomeric SMILES: [2H]C([2H])(CCCCCCCCCCC)C([2H])([2H])Br
• Uses: 1-Bromotridecane-1,1,2,2-d4 (CAS# 284474-45-9) is a useful isotopically labeled research compound.