Structure

Dmab-oh

CAS
172611-73-3
Catalog Number
ACM172611733
Category
Other Products
Molecular Weight
329.43
Molecular Formula
C20H27NO3

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Specification

Synonyms
DMAB-OH;4-(N-[1-(4,4-DIMETHYL-2,6-DIOXOCYCLOHEXYLIDENE)-3-METHYLBUTYL]-AMINO) BENZYL ALCOHOL;2(1(4-HYDROXYME)PHE.AMINO)-3-ME.BUTYLI-;2-{1-[4-(HydroxyMethyl)phenylaMino]-3-Methylbutylidene}-5,5-diMethyl-1,3-cyclohexanedione;2-(1-((4-(Hydroxymethyl)phenyl)amino)-3-methylbutylidene)-5,5-dimethylcyclohexane-1,3-dione
What is the molecular formula of Dmab-OH?

The molecular formula of Dmab-OH is C20H27NO3.

What is the molecular weight of Dmab-OH?

The molecular weight of Dmab-OH is 329.4 g/mol.

What is the IUPAC name of Dmab-OH?

The IUPAC name of Dmab-OH is 3-hydroxy-2-[N-[4-(hydroxymethyl)phenyl]-C-(2-methylpropyl)carbonimidoyl]-5,5-dimethylcyclohex-2-en-1-one.

What is the InChI of Dmab-OH?

The InChI of Dmab-OH is InChI=1S/C20H27NO3/c1-13(2)9-16(21-15-7-5-14(12-22)6-8-15)19-17(23)10-20(3,4)11-18(19)24/h5-8,13,22-23H,9-12H2,1-4H3.

What is the InChIKey of Dmab-OH?

The InChIKey of Dmab-OH is UKAQNIKHOWTQFY-UHFFFAOYSA-N.

What is the canonical SMILES of Dmab-OH?

The canonical SMILES of Dmab-OH is CC(C)CC(=NC1=CC=C(C=C1)CO)C2=C(CC(CC2=O)(C)C)O.

What is the CAS number for Dmab-OH?

The CAS number for Dmab-OH is 172611-73-3.

What is the XLogP3-AA value for Dmab-OH?

The XLogP3-AA value for Dmab-OH is 3.2.

How many hydrogen bond donor counts does Dmab-OH have?

Dmab-OH has 2 hydrogen bond donor counts.

Is the compound canonicalized?

Yes, the compound is canonicalized.

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