Structure

z-Ligustilide

CAS
81944-09-4
Catalog Number
ACM81944094
Category
Other Products
Molecular Weight
190.23836
Molecular Formula
C12H14O2

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Specification

Synonyms
cis-Ligustilide;Ligustilide A;(3Z)-3-Butylidene-4,5-dihydro-1(3H)-isobenzofuranone;LIGUSTILIDE, Z-(IN ACETONITRILE)(10.2Mg/ML)(P)
Density
1.10±0.1 g/cm³ (20 ºC 760 Torr)
What is the molecular formula of z-Ligustilide?

The molecular formula of z-Ligustilide is C12H14O2.

What is the molecular weight of z-Ligustilide?

The molecular weight of z-Ligustilide is 190.24 g/mol.

What is the IUPAC name of z-Ligustilide?

The IUPAC name of z-Ligustilide is (3Z)-3-butylidene-4,5-dihydro-2-benzofuran-1-one.

What is the InChIKey of z-Ligustilide?

The InChIKey of z-Ligustilide is IQVQXVFMNOFTMU-FLIBITNWSA-N.

What is the Canonical SMILES of z-Ligustilide?

The Canonical SMILES of z-Ligustilide is CCCC=C1C2=C(C=CCC2)C(=O)O1.

What is the CAS number of z-Ligustilide?

The CAS number of z-Ligustilide is 4431-01-0.

What is the XLogP3-AA value of z-Ligustilide?

The XLogP3-AA value of z-Ligustilide is 2.7.

How many hydrogen bond acceptors does z-Ligustilide have?

z-Ligustilide has 2 hydrogen bond acceptors.

What is the topological polar surface area of z-Ligustilide?

The topological polar surface area of z-Ligustilide is 26.3 Å^2.

How many heavy atoms does z-Ligustilide contain?

z-Ligustilide contains 14 heavy atoms.

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