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Structure

(Z,Z)-3,13-octadecadienilo acetate

CAS
53120-27-7
Catalog Number
ACM53120277
Category
Insect Pheromone
Molecular Weight
308.5
Molecular Formula
C20H36O2

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Specification

Synonyms
Z3,Z13-18:Ac
IUPAC Name
[(3Z,13Z)-octadeca-3,13-dienyl] acetate
InChI Key
VVJPJXKHBZNADP-DNNFRFAMSA-N
Boiling Point
390.3ºC at 760mmHg
Flash Point
97.6ºC
Density
0.882g/cm³
Exact Mass
308.27200
H-Bond Acceptor
2
H-Bond Donor
0
What is the chemical formula of (Z,Z)-3,13-octadecadienyl acetate?

The chemical formula of (Z,Z)-3,13-octadecadienyl acetate is C20H36O2.

What is the molecular weight of (Z,Z)-3,13-octadecadienyl acetate?

The molecular weight of (Z,Z)-3,13-octadecadienyl acetate is 308.5 g/mol.

What is the IUPAC name of (Z,Z)-3,13-octadecadienyl acetate?

The IUPAC name of (Z,Z)-3,13-octadecadienyl acetate is [(3Z,13Z)-octadeca-3,13-dienyl] acetate.

What is the InChI of (Z,Z)-3,13-octadecadienyl acetate?

The InChI of (Z,Z)-3,13-octadecadienyl acetate is InChI=1S/C20H36O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-22-20(2)21/h6-7,16-17H,3-5,8-15,18-19H2,1-2H3/b7-6-,17-16-.

What is the InChIKey of (Z,Z)-3,13-octadecadienyl acetate?

The InChIKey of (Z,Z)-3,13-octadecadienyl acetate is VVJPJXKHBZNADP-DNNFRFAMSA-N.

What is the canonical SMILES of (Z,Z)-3,13-octadecadienyl acetate?

The canonical SMILES of (Z,Z)-3,13-octadecadienyl acetate is CCCCC=CCCCCCCCCC=CCCOC(=O)C.

How many hydrogen bond donor counts does (Z,Z)-3,13-octadecadienyl acetate have?

(Z,Z)-3,13-octadecadienyl acetate has 0 hydrogen bond donor counts.

How many hydrogen bond acceptor counts does (Z,Z)-3,13-octadecadienyl acetate have?

(Z,Z)-3,13-octadecadienyl acetate has 2 hydrogen bond acceptor counts.

How many rotatable bond counts does (Z,Z)-3,13-octadecadienyl acetate have?

(Z,Z)-3,13-octadecadienyl acetate has 16 rotatable bond counts.

What is the topological polar surface area of (Z,Z)-3,13-octadecadienyl acetate?

The topological polar surface area of (Z,Z)-3,13-octadecadienyl acetate is 26.3 ?2.

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