Structure

d4-Cml

CAS
936233-18-0
Catalog Number
ACM936233180
Category
Other Products
Molecular Weight
208.249
Molecular Formula
C8H12D4N2O4

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Specification

Synonyms
d4-CML
What is the molecular formula of d4-CML according to the reference?

The molecular formula of d4-CML is C8H16N2O4.

When was d4-CML created according to the reference?

d4-CML was created on February 12, 2007.

What is the molecular weight of d4-CML?

The molecular weight of d4-CML is 204.22 g/mol.

What is the IUPAC name of d4-CML?

The IUPAC name of d4-CML is 2-amino-6-(carboxymethylamino)hexanoic acid.

What is the Canonical SMILES of d4-CML?

The Canonical SMILES of d4-CML is C(CCNCC(=O)O)CC(C(=O)O)N.

What is the InChIKey of d4-CML?

The InChIKey of d4-CML is NUXSIDPKKIEIMI-UHFFFAOYSA-N.

How many hydrogen bond donor counts are in d4-CML?

There are 4 hydrogen bond donor counts in d4-CML.

What is the XLogP3 value of d4-CML?

The XLogP3 value of d4-CML is -5.2.

What is the topological polar surface area of d4-CML?

The topological polar surface area of d4-CML is 113 Å2.

Is the compound canonicalized according to the reference?

Yes, the compound is canonicalized according to the reference.

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