4-ISOPROPYL-5,5-DIMETHYL-1,3-DIOXANE

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NCATS

Details

Stereochemistry	RACEMIC
Molecular Formula	C9H18O2
Molecular Weight	158.238
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4-ISOPROPYL-5,5-DIMETHYL-1,3-DIOXANE

Structure Search

SMILES

CC(C)C1OCOCC1(C)C

InChI

InChIKey=KBYHWUXTLMRZHL-UHFFFAOYSA-N

InChI=1S/C9H18O2/c1-7(2)8-9(3,4)5-10-6-11-8/h7-8H,5-6H2,1-4H3

HIDE SMILES / InChI

Approval Year

Name

Type

Language

4-ISOPROPYL-5,5-DIMETHYL-1,3-DIOXANE

Systematic Name

English

NSC-48577

Preferred Name

English

1,3-DIOXANE, 5,5-DIMETHYL-4-(1-METHYLETHYL)-

Systematic Name

English

M-DIOXANE, 4-ISOPROPYL-5,5-DIMETHYL-

Systematic Name

English

5,5-DIMETHYL-4-(1-METHYLETHYL)-1,3-DIOXANE

Systematic Name

English

Code System Code Type Description

EPA CompTox

DTXSID6052035

Created by admin on Mon Mar 31 22:04:41 GMT 2025 , Edited by admin on Mon Mar 31 22:04:41 GMT 2025

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CAS

3583-00-4

Created by admin on Mon Mar 31 22:04:41 GMT 2025 , Edited by admin on Mon Mar 31 22:04:41 GMT 2025

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NSC

48577

Created by admin on Mon Mar 31 22:04:41 GMT 2025 , Edited by admin on Mon Mar 31 22:04:41 GMT 2025

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PUBCHEM

96021

Created by admin on Mon Mar 31 22:04:41 GMT 2025 , Edited by admin on Mon Mar 31 22:04:41 GMT 2025

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FDA UNII

TI8LRS7LDS

Created by admin on Mon Mar 31 22:04:41 GMT 2025 , Edited by admin on Mon Mar 31 22:04:41 GMT 2025

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ECHA (EC/EINECS)

222-709-6

Created by admin on Mon Mar 31 22:04:41 GMT 2025 , Edited by admin on Mon Mar 31 22:04:41 GMT 2025

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SUBSTANCE RECORD


					TI8LRS7LDS

4-ISOPROPYL-5,5-DIMETHYL-1,3-DIOXANE