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AA-516/30131001 is available in 7543 mg

Compound details
MDL #:		MFCD00040746
Formula:		C8 H7 N O2
Weight:		149.15
Chiral info:		Not available
Name:		3-(4-pyridinyl)acrylic acid
SMILES:		OC(=O)C=Cc1ccncc1
InChI^TM:		InChI=1S/C8H7NO2/c10-8(11)2-1-7-3-5-9-6-4-7/h1-6H,(H,10,11)
InChIKey^TM:		SSAYTINUCCRGDR-UHFFFAOYSA-N

Toxicity predictions
Rat Oral LD₅₀:		6770 mg/Kg
Chronic LOAEL:		69 mg/Kg
Developmental Toxicity Potential:		0.76

Chemical properties calculations
LogP:	0.88	H-acceptors: 3
LogS:	-0.65	H-donors: 1
tPSA:	50.19 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.