2-Methylcrotonic acid(3ar,4r,7r,9s,10z,11ar)-2,3,3a,4,5,6,7,8,9,11a-decahydro-7,9-dihydroxy-10-methyl-3,6-bis(methylene)-2-oxocyclodeca[b]furan-4-yl ester

CAS

97233-10-8

Catalog Number

ACM97233108

Category

Other Products

MSDS COA Spec Sheet

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What is the molecular formula of 2-Methylcrotonic acid(3ar,4r,7r,9s,10z,11ar)-2,3,3a,4,5,6,7,8,9,11a-decahydro-7,9-dihydroxy-10-methyl-3,6-bis(methylene)-2-oxocyclodeca[b]furan-4-yl ester?

The molecular formula is C20H26O6.

What is the molecular weight of 2-Methylcrotonic acid?

The molecular weight is 362.4 g/mol.

What is another name for 2-Methylcrotonic acid?

Another name is Calbertolide C.

When was 2-Methylcrotonic acid first created and modified?

It was first created on February 16, 2015, and last modified on December 30, 2023.

What is the IUPAC name of 2-Methylcrotonic acid?

The IUPAC name is [(3aR,4R,7R,9S,10Z,11aR)-7,9-dihydroxy-10-methyl-3,6-dimethylidene-2-oxo-4,5,7,8,9,11a-hexahydro-3aH-cyclodeca[b]furan-4-yl] (E)-2-methylbut-2-enoate.

What is the InChI of 2-Methylcrotonic acid?

The InChI is InChI=1S/C20H26O6/c1-6-10(2)19(23)25-16-7-11(3)14(21)9-15(22)12(4)8-17-18(16)13(5)20(24)26-17/h6,8,14-18,21-22H,3,5,7,9H2,1-2,4H3/b10-6+,12-8-/t14-,15+,16-,17-,18-/m1/s1.

How many hydrogen bond donor counts does 2-Methylcrotonic acid have?

It has 2 hydrogen bond donor counts.

What is the XLogP3-AA value of 2-Methylcrotonic acid?

The XLogP3-AA value is 1.5.

What is the topological polar surface area of 2-Methylcrotonic acid?

The topological polar surface area is 93.1 Å².

How many defined bond stereocenter counts does 2-Methylcrotonic acid have?

It has 2 defined bond stereocenter counts.

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