4,4-DIMETHYL-1,3-DIOXANE

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C6H12O2
Molecular Weight	116.1583
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4,4-DIMETHYL-1,3-DIOXANE

Structure Search

SMILES

CC1(C)CCOCO1

InChI

InChIKey=GDKSTFXHMBGCPG-UHFFFAOYSA-N

InChI=1S/C6H12O2/c1-6(2)3-4-7-5-8-6/h3-5H2,1-2H3

HIDE SMILES / InChI

Molecular Formula	C6H12O2
Molecular Weight	116.1583
Charge	0
Count

Stereochemistry	ACHIRAL
Additional Stereochemistry	No
Defined Stereocenters	0 / 0
E/Z Centers	0
Optical Activity	NONE

Approval Year

PubMed

PubMed

Title	Date	PubMed
Freshness characterisation of whiting (Merlangius merlangus) using an SPME/GC/MS method and a statistical multivariate approach.	2010 Dec	20718023

Patents

Patents

Substance Class	Chemical Created by `admin` on `Fri Dec 15 18:55:35 GMT 2023` Edited by `admin` on `Fri Dec 15 18:55:35 GMT 2023`
Record UNII	WSB4HQ824O
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

4,4-DIMETHYL-1,3-DIOXANE

Systematic Name

English

1,3-DIOXANE, 4,4-DIMETHYL-

Systematic Name

English

M-DIOXANE, 4,4-DIMETHYL-

Systematic Name

English

4,4-DIMETHYL-M-DIOXANE

Systematic Name

English

Code System Code Type Description

MESH

C058099

Created by admin on Fri Dec 15 18:55:35 GMT 2023 , Edited by admin on Fri Dec 15 18:55:35 GMT 2023

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FDA UNII

WSB4HQ824O

Created by admin on Fri Dec 15 18:55:35 GMT 2023 , Edited by admin on Fri Dec 15 18:55:35 GMT 2023

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EPA CompTox

DTXSID7074296

Created by admin on Fri Dec 15 18:55:35 GMT 2023 , Edited by admin on Fri Dec 15 18:55:35 GMT 2023

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PUBCHEM

13008

Created by admin on Fri Dec 15 18:55:35 GMT 2023 , Edited by admin on Fri Dec 15 18:55:35 GMT 2023

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CAS

766-15-4

Created by admin on Fri Dec 15 18:55:35 GMT 2023 , Edited by admin on Fri Dec 15 18:55:35 GMT 2023

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