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AB-131/40897205 is available in 10425 mg

Compound details
MDL #:		MFCD00091593
Formula:		C10 H14 O2 S
Weight:		198.28
Chiral info:		Not available
Name:		isopropyl4-methylphenylsulfone
SMILES:		CC(C)S(=O)(=O)c1ccc(C)cc1
InChI^TM:		InChI=1S/C10H14O2S/c1-8(2)13(11,12)10-6-4-9(3)5-7-10/h4-8H,1-3H3
InChIKey^TM:		DUJYZGXBCPOPDD-UHFFFAOYSA-N

Toxicity predictions
Rat Oral LD₅₀:		3060 mg/Kg
Chronic LOAEL:		284 mg/Kg
Developmental Toxicity Potential:		0.94

Chemical properties calculations
LogP:	2.02	H-acceptors: 2
LogS:	-2.37
tPSA:	42.52 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.