(E)-3-Hexenyl(2Z,4Z)-2,4-decadienoate

CAS

94109-96-3

Catalog Number

ACM94109963

Category

Other Products

Molecular Weight

250.376440 [g/mol]

Molecular Formula

C₁₆H₂₆O₂

MSDS COA Spec Sheet

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Specification

Synonyms

EINECS 302-536-3, (E)-3-Hexenyl (2Z,4Z)-2,4-decadienoate, 94109-96-3

IUPAC Name

[(E)-hex-3-enyl] (2Z,4Z)-deca-2,4-dienoate

Canonical SMILES

CCCCCC=CC=CC(=O)OCCC=CCC

InChI Key

GDCDHOABPPVBLT-DBQLZJNWSA-N

Boiling Point

341.9ºC at 760mmHg

Flash Point

168.1ºC

Density

0.903g/cm³

EC Number

302-536-3

Exact Mass

250.19300

H-Bond Acceptor

H-Bond Donor

What is the molecular formula of (E)-3-Hexenyl(2Z,4Z)-2,4-decadienoate?

The molecular formula is C16H26O2.

When was (E)-3-Hexenyl(2Z,4Z)-2,4-decadienoate first created in PubChem?

It was first created on December 5, 2007.

What is the IUPAC name of (E)-3-Hexenyl(2Z,4Z)-2,4-decadienoate?

The IUPAC name is [(E)-hex-3-enyl] (2Z,4Z)-deca-2,4-dienoate.

What is the InChIKey of (E)-3-Hexenyl(2Z,4Z)-2,4-decadienoate?

The InChIKey is GDCDHOABPPVBLT-DBQLZJNWSA-N.

How many hydrogen bond donor counts are there in (E)-3-Hexenyl(2Z,4Z)-2,4-decadienoate?

There are 0 hydrogen bond donor counts.

What is the XLogP3-AA value of (E)-3-Hexenyl(2Z,4Z)-2,4-decadienoate?

The XLogP3-AA value is 5.4.

What is the topological polar surface area of (E)-3-Hexenyl(2Z,4Z)-2,4-decadienoate?

The topological polar surface area is 26.3 Å2.

How many defined bond stereocenter counts are there in (E)-3-Hexenyl(2Z,4Z)-2,4-decadienoate?

There are 3 defined bond stereocenter counts.

What is the exact mass of (E)-3-Hexenyl(2Z,4Z)-2,4-decadienoate?

The exact mass is 250.193280068 g/mol.

Is the compound is canonicalized for (E)-3-Hexenyl(2Z,4Z)-2,4-decadienoate?

Yes, the compound is canonicalized.

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