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Details

Stereochemistry RACEMIC
Molecular Formula 2C13H17O2.Al.HO
Molecular Weight 454.5346
Optical Activity UNSPECIFIED
Defined Stereocenters 0 / 2
E/Z Centers 0
Charge 0
Stereo Comments IBUPROFEN

SHOW SMILES / InChI
Structure of IBUPROFEN ALUMINUM

SMILES

[OH-].[Al+3].CC(C)CC1=CC=C(C=C1)C(C)C([O-])=O.CC(C)CC2=CC=C(C=C2)C(C)C([O-])=O

InChI

InChIKey=QAZIXAUMDFPQRW-UHFFFAOYSA-K
InChI=1S/2C13H18O2.Al.H2O/c2*1-9(2)8-11-4-6-12(7-5-11)10(3)13(14)15;;/h2*4-7,9-10H,8H2,1-3H3,(H,14,15);;1H2/q;;+3;/p-3

HIDE SMILES / InChI

Molecular Formula C13H17O2
Molecular Weight 205.2729
Charge -1
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Molecular Formula HO
Molecular Weight 17.0073
Charge -1
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula Al
Molecular Weight 26.9815
Charge 3
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 Fri Dec 15 16:41:29 UTC 2023
Edited
by admin
on Fri Dec 15 16:41:29 UTC 2023
Record UNII
D0YGZ1VO1B
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
IBUPROFEN ALUMINUM
USAN  
USAN  
Official Name English
IBUPROFEN ALUMINIUM
Common Name English
U-18,573G
Code English
ALUMINUM IBUPROFEN
Common Name English
U-18573G
Code English
MOTRIN A
Brand Name English
(±)-HYDROXYBIS(P-ISOBUTYLHYDRATROPATO)ALUMINIUM
Common Name English
HYDROXYALUMINIUM BIS,(2-(P-ISOBUTYLPHENYL)PROPRIONATE)
Common Name English
ALUMINUM, HYDROXYBIS(.ALPHA.-METHYL-4-(2-METHYLPROPYL)BENZENEACETATO-.KAPPA.O)-
Common Name English
ALUMINUM, HYDROXYBIS(.ALPHA.-METHYL-4-(2-METHYLPROPYL)BENZENEACETATO-O)-, (±)-
Common Name English
ALUMINIUM, HYDROXYBIS(.ALPHA.-METHYL-4-(2-METHYLPROPYL)BENZENEACETATO-O)-, (±)-
Common Name English
(±)-HYDROXYBIS(P-ISOBUTYLHYDRATROPATO)ALUMINUM
Common Name English
IBUPROFEN ALUMINUM [USAN]
Common Name English
U 18573G
Code English
ALUMINIUM IBUPROFEN
Common Name English
ALUMINIUM, HYDROXYBIS(.ALPHA.-METHYL-4-(2-METHYLPROPYL)BENZENEACETATO-.KAPPA.O)-
Common Name English
Code System Code Type Description
FDA UNII
D0YGZ1VO1B
Created by admin on Fri Dec 15 16:41:29 UTC 2023 , Edited by admin on Fri Dec 15 16:41:29 UTC 2023
PRIMARY
DRUG BANK
DBSALT002285
Created by admin on Fri Dec 15 16:41:29 UTC 2023 , Edited by admin on Fri Dec 15 16:41:29 UTC 2023
PRIMARY
NCI_THESAURUS
C174664
Created by admin on Fri Dec 15 16:41:29 UTC 2023 , Edited by admin on Fri Dec 15 16:41:29 UTC 2023
PRIMARY
PUBCHEM
9890190
Created by admin on Fri Dec 15 16:41:29 UTC 2023 , Edited by admin on Fri Dec 15 16:41:29 UTC 2023
PRIMARY
EPA CompTox
DTXSID001316141
Created by admin on Fri Dec 15 16:41:29 UTC 2023 , Edited by admin on Fri Dec 15 16:41:29 UTC 2023
PRIMARY
CAS
61054-06-6
Created by admin on Fri Dec 15 16:41:29 UTC 2023 , Edited by admin on Fri Dec 15 16:41:29 UTC 2023
PRIMARY
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