CAS
94085-85-4 Purity
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94085-85-4 Purity
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Specification
The molecular formula is C18H32LiNO4.
It was created on August 20, 2009.
The synonyms include EINECS 301-828-8 and 94086-41-6.
The Molecular Weight is 333.4 g/mol.
It has 4 Hydrogen Bond Acceptor Counts.
The Topological Polar Surface Area is 89.5 Ų.
It has 15 Rotatable Bond Counts.
Yes, it is a Canonicalized compound.
The Canonical SMILES is [Li+].CCCCCCCCCCCCC(=CC(=O)[O-])C(=O)NCCO.
The Component Compounds are Lithium and ((Z)-3-(2-hydroxyethylcarbamoyl)pentadec-2-enoic acid).