93964-26-2 Purity
96%
If you have any other questions or need other size, please get a quote.
Specification
The molecular formula is C18H32LiNO4.
It was created on February 5, 2008.
The molecular weight is 333.4 g/mol.
The IUPAC name is lithium;(E)-3-(2-aminoethoxycarbonyl)pentadec-5-enoate.
The InChI is InChI=1S/C18H33NO4.Li/c1-2-3-4-5-6-7-8-9-10-11-12-16(15-17(20)21)18(22)23-14-13-19;/h10-11,16H,2-9,12-15,19H2,1H3,(H,20,21);/q;+1/p-1/b11-10+;
The Canonical SMILES is [Li+].CCCCCCCCCC=CCC(CC(=O)[O-])C(=O)OCCN.
The CAS number is 93964-35-3.
It has 5 hydrogen bond acceptor counts.
It has 16 rotatable bond counts.
Yes, it is canonicalized according to PubChem.