Specs - Compound Management services and Research Compounds for the Life Science industry

Specs ID search result

AM-331/20714013 is available in 1713 mg

Compound details
Formula:		C8 H8 O4
Weight:		168.15
Chiral info:		Not available
Name:		Vanillic acid
SMILES:		COc1cc(ccc1(O))C(O)=O
InChI^TM:		InChI=1S/C8H8O4/c1-12-7-4-5(8(10)11)2-3-6(7)9/h2-4,9H,1H3,(H,10,11)
InChIKey^TM:		WKOLLVMJNQIZCI-UHFFFAOYSA-N

Toxicity predictions
Rat Oral LD₅₀:		388 mg/Kg
Chronic LOAEL:		526 mg/Kg
Developmental Toxicity Potential:		0.03

Chemical properties calculations
LogP:	1.43	H-acceptors: 2
LogS:	-1.65	H-donors: 2
tPSA:	66.76 Å²	Rotatable bonds: 2

Purchase 10 mg of AM-331/20714013 for only 81 USD after login to Specs.net! Receive your compounds in clear glass vials within 5 working days after ordering via Specs.net. Please logon to Specs.net using your personal account or register as new user here.

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.