4-Chlorobenzoin Structure

4-Chlorobenzoin

Chemical Properties

Melting point 89-93 °C(lit.)
Boiling point 407.1±30.0 °C(Predicted)
Density  1.285±0.06 g/cm3(Predicted)
pka 11.82±0.20(Predicted)
form  solid
InChI 1S/C14H11ClO2/c15-12-8-6-11(7-9-12)14(17)13(16)10-4-2-1-3-5-10/h1-9,13,16H
InChIKey XYUKKJIDPMMCMJ-UHFFFAOYSA-N
SMILES OC(c1ccccc1)C(=O)c2ccc(Cl)cc2
Comptox DTXSID DTXSID60543509
UNSPSC Code 12352100
NACRES NA.22

Safety

Symbol(GHS) Exclamation Mark (GHS07)
Signal wordWarning
Hazard statements H302
Precautionary statements P264-P270-P301+P312-P501
Hazard Codes  Xn
Risk Statements  22
Safety Statements  36/37
WGK Germany  3
HS Code  2914790090
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Oral

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