Chelidamic acid
- Product NameChelidamic acid
- CAS138-60-3
- CBNumberCB2220457
- MFC7H5NO5
- MW183.12
- EINECS205-335-8
- MDL NumberMFCD00066478
- MOL File138-60-3.mol
- MSDS FileSDS
Chemical Properties
Melting point | 265-270 °C |
Boiling point | 428.3±45.0 °C(Predicted) |
Density | 1.726±0.06 g/cm3(Predicted) |
storage temp. | Keep in dark place,Sealed in dry,Room Temperature |
solubility | 1 M NH4OH: 50mg/mL, clear to slightly hazy |
pka | 0.12±0.40(Predicted) |
form | powder |
color | brown |
biological source | synthetic (organic) |
BRN | 476229 |
InChI | InChI=1S/C7H5NO5/c9-3-1-4(6(10)11)8-5(2-3)7(12)13/h1-2H,(H,8,9)(H,10,11)(H,12,13) |
InChIKey | XTLJJHGQACAZMS-UHFFFAOYSA-N |
SMILES | C1(C(O)=O)NC(C(O)=O)=CC(=O)C=1 |
CAS DataBase Reference | 138-60-3(CAS DataBase Reference) |
FDA UNII | 1A59BH8SXE |
Safety
Symbol(GHS) | ||||||||||
Signal word | Warning | |||||||||
Hazard statements | H315-H319-H335 | |||||||||
Precautionary statements | P261-P264-P271-P280-P302+P352-P305+P351+P338 | |||||||||
Hazard Codes | Xi | |||||||||
Risk Statements | 36/37/38 | |||||||||
Safety Statements | 26-36 | |||||||||
WGK Germany | 3 | |||||||||
HS Code | 29333990 | |||||||||
NFPA 704: |
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