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Structure

3-Butoxy-3-oxopropyl butyrate

CAS
97552-57-3
Catalog Number
ACM97552573
Category
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What is the molecular formula of 3-Butoxy-3-oxopropyl butyrate?

The molecular formula of 3-Butoxy-3-oxopropyl butyrate is C11H20O4.

When was 3-Butoxy-3-oxopropyl butyrate created and modified according to the reference?

3-Butoxy-3-oxopropyl butyrate was created on 2007-07-11 and modified on 2023-12-30.

What is the IUPAC Name of 3-Butoxy-3-oxopropyl butyrate?

The IUPAC Name of 3-Butoxy-3-oxopropyl butyrate is (3-butoxy-3-oxopropyl) butanoate.

What is the InChIKey of 3-Butoxy-3-oxopropyl butyrate?

The InChIKey of 3-Butoxy-3-oxopropyl butyrate is ZNEZWMOQTITMOQ-UHFFFAOYSA-N.

How many hydrogen bond acceptors are there in 3-Butoxy-3-oxopropyl butyrate?

There are 4 hydrogen bond acceptors in 3-Butoxy-3-oxopropyl butyrate.

What is the topological polar surface area of 3-Butoxy-3-oxopropyl butyrate?

The topological polar surface area of 3-Butoxy-3-oxopropyl butyrate is 52.6 Å2.

Is 3-Butoxy-3-oxopropyl butyrate a canonicalized compound?

Yes, 3-Butoxy-3-oxopropyl butyrate is a canonicalized compound.

What is the exact mass of 3-Butoxy-3-oxopropyl butyrate?

The exact mass of 3-Butoxy-3-oxopropyl butyrate is 216.13615911 g/mol.

How many rotatable bonds are there in 3-Butoxy-3-oxopropyl butyrate?

There are 10 rotatable bonds in 3-Butoxy-3-oxopropyl butyrate.

What is the complexity value of 3-Butoxy-3-oxopropyl butyrate?

The complexity value of 3-Butoxy-3-oxopropyl butyrate is 189.

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