5-Isobutyl-1,3-dimethylbarbituric acid

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NCATS

Details

Stereochemistry	ACHIRAL
Molecular Formula	C10H16N2O3
Molecular Weight	212.2456
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 5-Isobutyl-1,3-dimethylbarbituric acid

Structure Search

SMILES

CC(C)CC1C(=O)N(C)C(=O)N(C)C1=O

InChI

InChIKey=NFQAQKVFBFWVKQ-UHFFFAOYSA-N

InChI=1S/C10H16N2O3/c1-6(2)5-7-8(13)11(3)10(15)12(4)9(7)14/h6-7H,5H2,1-4H3

HIDE SMILES / InChI

Molecular Formula	C10H16N2O3
Molecular Weight	212.2456
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 12:10:12 GMT 2023` Edited by `admin` on `Sat Dec 16 12:10:12 GMT 2023`
Record UNII	3PA2UF3QHN
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

5-Isobutyl-1,3-dimethylbarbituric acid

Systematic Name

English

2,4,6(1H,3H,5H)-Pyrimidinetrione, 1,3-dimethyl-5-(2-methylpropyl)-

Systematic Name

English

1,3-Dimethyl-5-(2-methylpropyl)-2,4,6(1H,3H,5H)-pyrimidinetrione

Systematic Name

English

Code System Code Type Description

CAS

7435-61-2

Created by admin on Sat Dec 16 12:10:12 GMT 2023 , Edited by admin on Sat Dec 16 12:10:12 GMT 2023

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EPA CompTox

DTXSID80225355

Created by admin on Sat Dec 16 12:10:12 GMT 2023 , Edited by admin on Sat Dec 16 12:10:12 GMT 2023

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FDA UNII

3PA2UF3QHN

Created by admin on Sat Dec 16 12:10:12 GMT 2023 , Edited by admin on Sat Dec 16 12:10:12 GMT 2023

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ECHA (EC/EINECS)

231-085-4

Created by admin on Sat Dec 16 12:10:12 GMT 2023 , Edited by admin on Sat Dec 16 12:10:12 GMT 2023

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PUBCHEM

81938

Created by admin on Sat Dec 16 12:10:12 GMT 2023 , Edited by admin on Sat Dec 16 12:10:12 GMT 2023

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