2,2,5-Trimethyl-1,3-dioxane-4,6-dione

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C7H10O4
Molecular Weight	158.1519
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 2,2,5-Trimethyl-1,3-dioxane-4,6-dione

Structure Search

SMILES

CC1C(=O)OC(C)(C)OC1=O

InChI

InChIKey=KJMCAXYHYPDRAV-UHFFFAOYSA-N

InChI=1S/C7H10O4/c1-4-5(8)10-7(2,3)11-6(4)9/h4H,1-3H3

HIDE SMILES / InChI

Molecular Formula	C7H10O4
Molecular Weight	158.1519
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 12:00:50 GMT 2023` Edited by `admin` on `Sat Dec 16 12:00:50 GMT 2023`
Record UNII	K6BV95MJT8
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2,2,5-Trimethyl-1,3-dioxane-4,6-dione

Systematic Name

English

1,3-Dioxane-4,6-dione, 2,2,5-trimethyl-

Systematic Name

English

2,2,5-Trimethyl-1,3-dioxan-4,6-dione

Systematic Name

English

2,2,5-Trimethyl-m-dioxane-4,6-dione

Systematic Name

English

Methyl Meldrum's acid

Common Name

English

NSC-233870

Code

English

Code System Code Type Description

EPA CompTox

DTXSID90190585

Created by admin on Sat Dec 16 12:00:50 GMT 2023 , Edited by admin on Sat Dec 16 12:00:50 GMT 2023

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ECHA (EC/EINECS)

223-050-7

Created by admin on Sat Dec 16 12:00:50 GMT 2023 , Edited by admin on Sat Dec 16 12:00:50 GMT 2023

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PUBCHEM

77299

Created by admin on Sat Dec 16 12:00:50 GMT 2023 , Edited by admin on Sat Dec 16 12:00:50 GMT 2023

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FDA UNII

K6BV95MJT8

Created by admin on Sat Dec 16 12:00:50 GMT 2023 , Edited by admin on Sat Dec 16 12:00:50 GMT 2023

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NSC

233870

Created by admin on Sat Dec 16 12:00:50 GMT 2023 , Edited by admin on Sat Dec 16 12:00:50 GMT 2023

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CAS

3709-18-0

Created by admin on Sat Dec 16 12:00:50 GMT 2023 , Edited by admin on Sat Dec 16 12:00:50 GMT 2023

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