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AK-968/41170352 is available in 87 mg

Compound details
MDL #:		MFCD03074501
Formula:		C14 H12 O5
Weight:		260.24
Chiral info:		Not available
Name:		methyl 5-[(3-formylphenoxy)methyl]-2-furoate
SMILES:		COC(=O)c2ccc(COc1cccc(C=O)c1)o2
InChI^TM:		InChI=1S/C14H12O5/c1-17-14(16)13-6-5-12(19-13)9-18-11-4-2-3-10(7-11)8-15/h2-8H,9H2,1H3
InChIKey^TM:		FTSWJSSQKLJWGH-UHFFFAOYSA-N

Toxicity predictions
Rat Oral LD₅₀:		8940 mg/Kg
Chronic LOAEL:		10 mg/Kg

Chemical properties calculations
LogP:	2.46	H-acceptors: 3
LogS:	-3.2
tPSA:	65.74 Å²	Rotatable bonds: 6

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Disclaimer: Predicted physical and biological properties, such as toxicity, mentioned on this website are indicative only and may not be relied upon in any way. Liability for damages of any kind resulting from reliance on these properties is expressly rejected.