Basic information Safety Related Supplier
Aristolochic acid Structure

Aristolochic acid

Chemical Properties

Melting point 260 °C
Boiling point 476.92°C (rough estimate)
Density  1.3162 (rough estimate)
refractive index  1.4500 (estimate)
storage temp.  2-8°C
solubility  DMSO: soluble
pka 2.99±0.20(Predicted)
form  powder
color  yellow
Major Application pharmaceutical (small molecule)
InChI InChI=1S/C17H11NO7/c1-23-12-4-2-3-8-9(12)5-11(18(21)22)14-10(17(19)20)6-13-16(15(8)14)25-7-24-13/h2-6H,7H2,1H3,(H,19,20)
InChIKey LIDQMWRBMLSXLL-UHFFFAOYSA-N
SMILES O1C2=C3C(=C(C(O)=O)C=C2OC1)C([N+]([O-])=O)=CC1C3=CC=CC=1OC
CAS DataBase Reference 313-67-7(CAS DataBase Reference)
IARC 1 (Vol. 82, 100A) 2012, 1 (Vol. 82, 100A) 2012

Safety Information

Hazard Codes  T
Risk Statements  25-68-36/37/38-23/24/25-45
Safety Statements  7-35-45-36/37/39-26-53
RIDADR  UN 1544 6.1/PG 3
WGK Germany  3
RTECS  CF3325000
HazardClass  6.1(b)
PackingGroup  III
HS Code  29329990
Storage Class 6.1C - Combustible acute toxic Cat.3
toxic compounds or compounds which causing chronic effects
Hazard Classifications Acute Tox. 3 Oral
Carc. 1A
Muta. 1B
Toxicity LD50 in male, female mice, male, female rats (mg/kg): 38.4, 70.1, 82.5, 74.0 i.v.; 55.9, 106.1, 203.4, 183.9 orally (Mengs)

Usage And Synthesis

Aristolochic acid Supplier

Aristolochic acid manufacturers