3,7,9-Trihydroxy-1-methyl-6H-dibenzo[b,d]pyran-6-one Structure

3,7,9-Trihydroxy-1-methyl-6H-dibenzo[b,d]pyran-6-one

Chemical Properties

Melting point 350°C (rough estimate)
Boiling point 321.48°C (rough estimate)
Density  1.2211 (rough estimate)
refractive index  1.4560 (estimate)
storage temp.  2-8°C
solubility  ≤0.5mg/ml in ethanol;30mg/ml in DMSO;30mg/ml in dimethyl formamide
pka 7.16±0.20(Predicted)
form  Solid
color  Off-white to brown
BRN  244839
Stability Hygroscopic
Major Application cleaning products
cosmetics
food and beverages
personal care
InChI 1S/C14H10O5/c1-6-2-7(15)5-11-12(6)9-3-8(16)4-10(17)13(9)14(18)19-11/h2-5,15-17H,1H3
InChIKey CEBXXEKPIIDJHL-UHFFFAOYSA-N
SMILES Cc1cc(O)cc2OC(=O)c3c(O)cc(O)cc3-c12
FDA UNII KN9L4260JW
UNSPSC Code 85151701
NACRES NA.77

Safety

Symbol(GHS) Skull and Crossbones (GHS06)
Signal wordDanger
Hazard statements H300+H310+H330
Precautionary statements P262-P280-P301+P310+P330-P302+P352+P310-P304+P340+P310
Hazard Codes  T+
Risk Statements  26/27/28
Safety Statements  28-36/37/39-45
RIDADR  UN 3462 6.1/PG 1
WGK Germany  3
RTECS  HP8757000
HazardClass  6.1(b)
PackingGroup  III
HS Code  29322090
Storage Class 6.1A - Combustible acute toxic Cat. 1 and 2
very toxic hazardous materials
Hazard Classifications Acute Tox. 1 Inhalation
Acute Tox. 2 Dermal
Acute Tox. 2 Oral
Toxicity LDLo intraperitoneal in mouse: 100mg/kg
NFPA 704:
0
4 0

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