495-27-2

Name OPHTHALMIC ACID
CAS 495-27-2
Molecular Formula C11H19N3O6
MDL Number MFCD00076874
Molecular Weight 289.29
MOL File 495-27-2.mol

Chemical Properties

Melting point  177-179 °C (decomp)
Boiling point  712.2±60.0 °C(Predicted)
density  1.341±0.06 g/cm3(Predicted)
storage temp.  -15°C
solubility  DMF: 5 mg/ml; DMSO: 5 mg/ml; Ethanol: 12 mg/ml; PBS (pH 7.2): 3 mg/ml
form  Solid
pka 2.22±0.10(Predicted)
color  White to off-white
Major Application clinical testing
InChI 1S/C11H19N3O6/c1-2-7(10(18)13-5-9(16)17)14-8(15)4-3-6(12)11(19)20/h6-7H,2-5,12H2,1H3,(H,13,18)(H,14,15)(H,16,17)(H,19,20)/t6-,7-/m0/s1
InChIKey JCMUOFQHZLPHQP-BQBZGAKWSA-N
SMILES N([C@@H](CC)C(=O)NCC(=O)O)C(=O)CC[C@H](N)C(=O)O

Safety Data

Symbol(GHS)  Flame (GHS02)Exclamation Mark (GHS07)
GHS02,GHS07
Signal word  Danger
Hazard statements  H225-H319
Precautionary statements  P210-P233-P240-P241-P242-P243-P264-P280-P303+P361+P353-P305+P351+P338-P337+P313-P370+P378-P403+P235-P501
WGK Germany  WGK 3
Storage Class 11 - Combustible Solids

Hazard Information

Supplier

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