AC1Q5SOO

2-hydroxypropane-1,2,3-tricarboxylic acid;2-(2-piperidin-1-ylethoxy)ethyl 2,2-diphenylcyclopropane-1-carboxylate

Also Known As: Cyclopropanecarboxylic acid, 2,2-diphenyl-, 2-(2-(1-piperidinyl)ethoxy)ethyl ester, 2-hydroxy-1,2,3-propanetricarboxylate|2-[2-(piperidin-1-yl)ethoxy]ethyl 2,2-diphenylcyclopropanecarboxylate 2-hydroxypropane-1,2,3-tricarboxylate(1:1)|2-hydroxypropane-1,2,3-tricarboxylic acid,2-(2-piperidin-1-ylethoxy)ethyl 2,2-diphenylcyclopropane-1-carboxylate|2-Hydroxypropane-1,2,3-tricarboxylic acid--2-[2-(piperidin-1-yl)ethoxy]ethyl 2,2-diphenylcyclopropane-1-carboxylate (1/1)|2-hydroxypropane-1,2,3-tricarboxylic acid; 2-(2-piperidin-1-ylethoxy)ethyl 2,2-diphenylcyclopropane-1-carboxylate|Cyclopropanecarboxylic acid,2,2-diphenyl-,2-(2-(1-piperidinyl)ethoxy)ethyl ester,2-hydroxy-1,2,3-propanetricarboxylate

Molecular Formula	C31H39NO10
Molecular Weight	585.2574 g/mol
LogP	2.7898
Topological Polar Surface Area	171.0 Ų
Hydrogen Bond Donors	4
Hydrogen Bond Acceptors	11
Rotatable Bonds	15
Exact Mass	585.2574
Monoisotopic Mass	585.2574
Heavy Atoms	42
Complexity	714.0

Chemical Identifiers

CAS Number	42013-69-4
SMILES	C1CCN(CC1)CCOCCOC(=O)C2CC2(C3=CC=CC=C3)C4=CC=CC=C4.C(C(=O)O)C(CC(=O)O)(C(=O)O)O
InChIKey	SHNOUZFEDGTMQS-UHFFFAOYSA-N