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AB-131/42302878 is available in 32 mg

Compound details
MDL #:		MFCD04971255
Formula:		C11 H11 O3
Weight:		191.2
Salt Data:		Na+
Chiral info:		Not available
Name:		3,3-dimethyl-2-phenyl-2-oxiranecarboxylate
SMILES:		CC2(C)(OC2(C(=O)[O-])(c1ccccc1))
InChI^TM:		InChI=1S/C11H12O3/c1-10(2)11(14-10,9(12)13)8-6-4-3-5-7-8/h3-7H,1-2H3,(H,12,13)/p-1
InChIKey^TM:		ABBBAXAFEXFVHF-UHFFFAOYSA-M

Toxicity predictions
Rat Oral LD₅₀:		4980 mg/Kg
Chronic LOAEL:		1140 mg/Kg

Chemical properties calculations
LogP:	2.43	H-acceptors: 3
LogS:	-2.28
tPSA:	52.66 Å²	Rotatable bonds: 2

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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.