7-(2-METHYLPROPYL)-1-(4-(2-METHYLPROPYL)PHENYL)-1,2,3,4-TETRAHYDRONAPHTHALENE-1,4-DICARBOXYLIC ACID

Details

Stereochemistry	RACEMIC
Molecular Formula	C26H32O4
Molecular Weight	408.5299
Optical Activity	( + / - )
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 7-(2-METHYLPROPYL)-1-(4-(2-METHYLPROPYL)PHENYL)-1,2,3,4-TETRAHYDRONAPHTHALENE-1,4-DICARBOXYLIC ACID

Structure Search

SMILES

[H][C@]1(CC[C@@](C(O)=O)(C2=CC=C(CC(C)C)C=C2)C3=C1C=CC(CC(C)C)=C3)C(O)=O

InChI

InChIKey=GXFQAIUKHDCTMF-ATIYNZHBSA-N

InChI=1S/C26H32O4/c1-16(2)13-18-5-8-20(9-6-18)26(25(29)30)12-11-22(24(27)28)21-10-7-19(14-17(3)4)15-23(21)26/h5-10,15-17,22H,11-14H2,1-4H3,(H,27,28)(H,29,30)/t22-,26-/m1/s1

HIDE SMILES / InChI

Molecular Formula	C26H32O4
Molecular Weight	408.5299
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:37:07 GMT 2023` Edited by `admin` on `Sat Dec 16 08:37:07 GMT 2023`
Record UNII	YH5RAY1N4B
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

7-(2-METHYLPROPYL)-1-(4-(2-METHYLPROPYL)PHENYL)-1,2,3,4-TETRAHYDRONAPHTHALENE-1,4-DICARBOXYLIC ACID

Systematic Name

English

(1RS,4RS)-7-(2-METHYLPROPYL)-1-(4-(2-METHYLPROPYL)PHENYL)-1,2,3,4-TETRAHYDRONAPHTHALENE-1,4-DICARBOXYLIC ACID

Systematic Name

English

1,4-NAPHTHALENEDICARBOXYLIC ACID, 1,2,3,4-TETRAHYDRO-7-(2-METHYLPROPYL)-1-(4-(2-METHYLPROPYL)PHENYL)-

Common Name

English

IBUPROFEN IMPURITY G [EP IMPURITY]

Common Name

English

Code System Code Type Description

FDA UNII

YH5RAY1N4B

Created by admin on Sat Dec 16 08:37:07 GMT 2023 , Edited by admin on Sat Dec 16 08:37:07 GMT 2023

PRIMARY

PUBCHEM

71588000

Created by admin on Sat Dec 16 08:37:07 GMT 2023 , Edited by admin on Sat Dec 16 08:37:07 GMT 2023

PRIMARY

CAS

1391054-15-1

Created by admin on Sat Dec 16 08:37:07 GMT 2023 , Edited by admin on Sat Dec 16 08:37:07 GMT 2023

NON-SPECIFIC STEREOCHEMISTRY

Related Record Type Details


					WK2XYI10QM

IBUPROFEN

PARENT -> IMPURITY

Interaction Type:

CHROMATOGRAPHIC PURITY (HPLC/UV)

Qualification:

EP

Amount: