AC1Q5SOJ

2-(diethylamino)ethyl 2-cyclohexyl-2-phenylpropanoate;2-hydroxypropane-1,2,3-tricarboxylic acid

Also Known As: alpha-Methyl-alpha-phenyl-cyclohexaneacetic acid 2-(diethylamino)ethyl ester citrate hydrate|2-(diethylamino)ethyl 2-cyclohexyl-2-phenylpropanoate 2-hydroxypropane-1,2,3-tricarboxylate(1:1)|Cyclohexaneacetic acid, alpha-methyl-alpha-phenyl-, 2-(diethylamino)ethyl ester, citrate, hydrate (1:1:1)|2-Hydroxypropane-1,2,3-tricarboxylic acid--2-(diethylamino)ethyl 2-cyclohexyl-2-phenylpropanoate (1/1)|2-(diethylamino)ethyl 2-cyclohexyl-2-phenylpropanoate,2-hydroxypropane-1,2,3-tricarboxylic acid|2-diethylaminoethyl 2-cyclohexyl-2-phenylpropanoate; 2-hydroxypropane-1,2,3-tricarboxylic acid

Molecular Formula	C27H41NO9
Molecular Weight	523.27814 g/mol
LogP	3.1611
Topological Polar Surface Area	162.0 Ų
Hydrogen Bond Donors	4
Hydrogen Bond Acceptors	10
Rotatable Bonds	14
Exact Mass	523.27814
Monoisotopic Mass	523.27814
Heavy Atoms	37
Complexity	595.0

Chemical Identifiers

CAS Number	33360-26-8
SMILES	CCN(CC)CCOC(=O)C(C)(C1CCCCC1)C2=CC=CC=C2.C(C(=O)O)C(CC(=O)O)(C(=O)O)O
InChIKey	JOJISMFMYAQGPC-UHFFFAOYSA-N