Isoquinoline-3-carboxylic acid

Melting point :166-167°C
Boiling point :366.4±17.0 °C(Predicted)
Density :1.339±0.06 g/cm3(Predicted)
storage temp. :2-8°C
solubility :DMF: 20 mg/ml; DMF:PBS(pH 7.2)(1:1): 0.5 mg/ml; DMSO: 20 mg/ml; Ethanol: 5 mg/ml
form :A crystalline solid
pka :1.20±0.30(Predicted)
color :Off-white to light yellow
InChI :InChI=1S/C10H7NO2/c12-10(13)9-5-7-3-1-2-4-8(7)6-11-9/h1-6H,(H,12,13)
InChIKey :KVMMIDQDXZOPAB-UHFFFAOYSA-N
SMILES :C1C2=C(C=CC=C2)C=C(C(O)=O)N=1
CAS DataBase Reference :6624-49-3(CAS DataBase Reference)

Symbol(GHS):
Signal word:	Warning
Hazard statements:	Code Hazard statements Hazard class Category Signal word Pictogram P-Codes H315 Causes skin irritation Skin corrosion/irritation Category 2 Warning P264, P280, P302+P352, P321,P332+P313, P362 H319 Causes serious eye irritation Serious eye damage/eye irritation Category 2A Warning P264, P280, P305+P351+P338,P337+P313P H335 May cause respiratory irritation Specific target organ toxicity, single exposure;Respiratory tract irritation Category 3 Warning
Precautionary statements:	P280 Wear protective gloves/protective clothing/eye protection/face protection.