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2-[(2R)-2-(Acetyloxy)tridecyl]-6-methoxy-2,5-cyclohexadiene-1,4-dione

2-[(2R)-2-(Acetyloxy)tridecyl]-6-methoxy-2,5-cyclohexadiene-1,4-dione structure

CAS No:
110979-06-1
Formula:
C22H34O5
Chemical Name:
2-[(2R)-2-(Acetyloxy)tridecyl]-6-methoxy-2,5-cyclohexadiene-1,4-dione
Synonyms:
2,5-Cyclohexadiene-1,4-dione,2-[(2R)-2-(acetyloxy)tridecyl]-6-methoxy-;2-[(2R)-2-(Acetyloxy)tridecyl]-6-methoxy-2,5-cyclohexadiene-1,4-dione;(-)-Cornudentanone;Cornudentanone

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Description

Cornudentanone is a carboxylic ester.

2-[(2R)-2-(Acetyloxy)tridecyl]-6-methoxy-2,5-cyclohexadiene-1,4-dione Basic Attributes

Molecular Weight：

378.5 g/mol

Exact Mass：

378.50

DSSTox ID：

DTXSID30331930

Characteristics

PSA：

69.7 Å²

2-[(2R)-2-(Acetyloxy)tridecyl]-6-methoxy-2,5-cyclohexadiene-1,4-dione Use and Manufacturing

Use Classification：

Fatty Acyls [FA] -> Fatty esters [FA07] -> Wax monoesters [FA0701]

Computed Properties

Molecular Weight:378.5
XLogP3:6
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:15
Exact Mass:378.24062418
Monoisotopic Mass:378.24062418
Topological Polar Surface Area:69.7
Heavy Atom Count:27
Complexity:559
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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Guide of 2-[(2R)-2-(Acetyloxy)tridecyl]-6-methoxy-2,5-cyclohexadiene-1,4-dione

Description
Basic Attributes
Characteristics
Use and Manufacturing
Computed Properties

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