936233-15-7 Purity
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Specification
The molecular formula of d4-CML is C8H16N2O4.
d4-CML was created on February 12, 2007.
The molecular weight of d4-CML is 204.22 g/mol.
The IUPAC name of d4-CML is 2-amino-6-(carboxymethylamino)hexanoic acid.
The Canonical SMILES of d4-CML is C(CCNCC(=O)O)CC(C(=O)O)N.
The InChIKey of d4-CML is NUXSIDPKKIEIMI-UHFFFAOYSA-N.
There are 4 hydrogen bond donor counts in d4-CML.
The XLogP3 value of d4-CML is -5.2.
The topological polar surface area of d4-CML is 113 Å2.
Yes, the compound is canonicalized according to the reference.