3-HYDROXYIBUPROFEN

Details

Stereochemistry	MIXED
Molecular Formula	C13H18O3
Molecular Weight	222.2802
Optical Activity	UNSPECIFIED
Defined Stereocenters	0 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CC(CO)CC1=CC=C(C=C1)C(C)C(O)=O

InChI

InChIKey=HFAIHLSDLUYLQA-UHFFFAOYSA-N

InChI=1S/C13H18O3/c1-9(8-14)7-11-3-5-12(6-4-11)10(2)13(15)16/h3-6,9-10,14H,7-8H2,1-2H3,(H,15,16)

HIDE SMILES / InChI

Molecular Formula	C13H18O3
Molecular Weight	222.2802
Charge	0
Count

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

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 21:23:15 GMT 2025` Edited by `admin` on `Mon Mar 31 21:23:15 GMT 2025`
Record UNII	C41B66XGBS
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2,4'-(2-HYDROXYMETHYLPROPYL)PHENYLPROPIONIC ACID

Preferred Name

English

3-HYDROXYIBUPROFEN

Common Name

English

3-HYDROXY-IBUPROFEN

Common Name

English

BENZENEACETIC ACID, 4-(3-HYDROXY-2-METHYLPROPYL)-.ALPHA.-METHYL-

Common Name

English

Code System Code Type Description

EPA CompTox

DTXSID301344828

Created by admin on Mon Mar 31 21:23:15 GMT 2025 , Edited by admin on Mon Mar 31 21:23:15 GMT 2025

PRIMARY

FDA UNII

C41B66XGBS

Created by admin on Mon Mar 31 21:23:15 GMT 2025 , Edited by admin on Mon Mar 31 21:23:15 GMT 2025

PRIMARY

PUBCHEM

71312545

Created by admin on Mon Mar 31 21:23:15 GMT 2025 , Edited by admin on Mon Mar 31 21:23:15 GMT 2025

PRIMARY

CAS

53949-54-5

Created by admin on Mon Mar 31 21:23:15 GMT 2025 , Edited by admin on Mon Mar 31 21:23:15 GMT 2025

PRIMARY

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IBUPROFEN

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