5,5-Dimethyl-2-butanal-1,3-dioxane

Catalog Number
ACMA00001982
Category
Ethers
Molecular Weight
186.25
Molecular Formula
C10H16ClNO

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Specification

Hazard Statements
H319
RIDADR
UN 1993C 3 / PGIII
Symbol
GHS07
What is the molecular formula of 5,5-Dimethyl-2-butanal-1,3-dioxane?

The molecular formula is C10H18O3.

What is the molecular weight of 5,5-Dimethyl-2-butanal-1,3-dioxane?

The molecular weight is 186.25 g/mol.

What is the IUPAC name of 5,5-Dimethyl-2-butanal-1,3-dioxane?

The IUPAC name is 4-(5,5-dimethyl-1,3-dioxan-2-yl)butanal.

What is the InChI of 5,5-Dimethyl-2-butanal-1,3-dioxane?

The InChI is InChI=1S/C10H18O3/c1-10(2)7-12-9(13-8-10)5-3-4-6-11/h6,9H,3-5,7-8H2,1-2H3.

What is the InChIKey of 5,5-Dimethyl-2-butanal-1,3-dioxane?

The InChIKey is KSKRSPYEXSAZRE-UHFFFAOYSA-N.

What is the canonical SMILES of 5,5-Dimethyl-2-butanal-1,3-dioxane?

The canonical SMILES is CC1(COC(OC1)CCCC=O)C.

What is the CAS number of 5,5-Dimethyl-2-butanal-1,3-dioxane?

The CAS number is 127600-13-9.

What is the Nikkaji Number of 5,5-Dimethyl-2-butanal-1,3-dioxane?

The Nikkaji Number is J2.423.627G.

Is 5,5-Dimethyl-2-butanal-1,3-dioxane a canonicalized compound?

Yes, it is canonicalized according to PubChem.

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