Hexadecanoic-13,13,14,14,15,15,16,16,16-d9 acid Structure

Hexadecanoic-13,13,14,14,15,15,16,16,16-d9 acid

Chemical Properties

Melting point 61-64°C
Boiling point 340.616±5.00 °C(Press: 760.00 Torr)(predicted)
Density  0.893±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
storage temp.  -20°C
solubility  DMF: 20 mg/ml; DMSO: 20 mg/ml; Ethanol: 30 mg/ml
form  A solid
pka 4.779±0.10(predicted)
InChI 1S/C16H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16(17)18/h2-15H2,1H3,(H,17,18)/i1D3,2D2,3D2,4D2
InChIKey IPCSVZSSVZVIGE-YNSOAAEFSA-N
SMILES [2H]C([2H])([2H])C([2H])([2H])C([2H])([2H])C([2H])([2H])CCCCCCCCCCCC(O)=O
UNSPSC Code 51113400
CAS Number Unlabeled 57-10-3

Safety

Symbol(GHS) Exclamation Mark (GHS07)
Signal wordWarning
Hazard statements H319
Precautionary statements P264-P280-P305+P351+P338-P337+P313P
Hazard Codes  Xi
Risk Statements  36
Safety Statements  26
WGK Germany  nwg
Storage Class 11 - Combustible Solids
NFPA 704:
0
2 0

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Hexadecanoic-13,13,14,14,15,15,16,16,16-d9 acid Chemical Properties,Usage,Production

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