5-ALLYL-5-(1,3-DIMETHYLBUTYL) BARBITURIC ACID

Details

Stereochemistry	RACEMIC
Molecular Formula	C13H20N2O3
Molecular Weight	252.3095
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 5-ALLYL-5-(1,3-DIMETHYLBUTYL) BARBITURIC ACID

Structure Search

SMILES

CC(C)CC(C)C1(CC=C)C(=O)NC(=O)NC1=O

InChI

InChIKey=WXJGERSUUYOBNA-UHFFFAOYSA-N

InChI=1S/C13H20N2O3/c1-5-6-13(9(4)7-8(2)3)10(16)14-12(18)15-11(13)17/h5,8-9H,1,6-7H2,2-4H3,(H2,14,15,16,17,18)

HIDE SMILES / InChI

Molecular Formula	C13H20N2O3
Molecular Weight	252.3095
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 09:53:34 UTC 2023` Edited by `admin` on `Sat Dec 16 09:53:34 UTC 2023`
Record UNII	HV4531YMT2
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

5-ALLYL-5-(1,3-DIMETHYLBUTYL) BARBITURIC ACID

Systematic Name

English

2,4,6(1H,3H,5H)-PYRIMIDINETRIONE, 5-(1,3-DIMETHYLBUTYL)-5-(2-PROPEN-1-YL)-

Systematic Name

English

SECOBARBITAL SODIUM, MIBK IMPURITY- [USP IMPURITY]

Common Name

English

5-ALLYL-5-(1,3-DIMETHYLBUTYL) BARBITURIC ACID, (±)-

Systematic Name

English

Code System Code Type Description

PUBCHEM

72941697

Created by admin on Sat Dec 16 09:53:34 UTC 2023 , Edited by admin on Sat Dec 16 09:53:34 UTC 2023

PRIMARY

FDA UNII

HV4531YMT2

Created by admin on Sat Dec 16 09:53:34 UTC 2023 , Edited by admin on Sat Dec 16 09:53:34 UTC 2023

PRIMARY

CAS

151262-55-4

Created by admin on Sat Dec 16 09:53:34 UTC 2023 , Edited by admin on Sat Dec 16 09:53:34 UTC 2023

PRIMARY

Related Record Type Details


					XBP604F6UM

SECOBARBITAL SODIUM

PARENT -> IMPURITY

Interaction Type:

CHROMATOGRAPHIC PURITY (HPLC/UV)

Qualification:

USP

Amount: