Gossypol-acetic acid Structure

Gossypol-acetic acid

Chemical Properties

Melting point 164-168°C
storage temp.  −20°C
solubility  Soluble in acetone or methanol at 5mg/ml
form  Solid
color  Yellow to Very Dark Yellow
Major Application food and beverages
InChIKey NIOHNDKHQHVLKA-UHFFFAOYSA-N
SMILES C12C(C(C)C)=C(C(O)=C(C=O)C=1C(O)=C(C1C(C)=CC3C(C(C)C)=C(O)C(O)=C(C=O)C=3C=1O)C(C)=C2)O.C(=O)(O)C
LogP 6.157 (est)
CAS DataBase Reference 12542-36-8(CAS DataBase Reference)
NCI Dictionary of Cancer Terms gossypol acetic acid
FDA UNII S7RL72610R
EPA Substance Registry System Gossypol acetic acid (12542-36-8)
UNSPSC Code 41116107
NACRES NA.24

Safety

Symbol(GHS) Exclamation Mark (GHS07)Health Hazard (GHS08)
Signal wordWarning
Hazard statements H302-H351
Precautionary statements P202-P264-P270-P280-P301+P312-P308+P313
Hazard Codes  Xn
Risk Statements  22-40
Safety Statements  22-36
WGK Germany  3
RTECS  MD7360000
HS Code  29153900
Storage Class 11 - Combustible Solids
Hazard Classifications Acute Tox. 4 Oral
Carc. 2
NFPA 704:
0
1 0

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