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Details

Stereochemistry ACHIRAL
Molecular Formula C15H22O3
Molecular Weight 250.3334
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3,5-DI-TERT-BUTYL-4-HYDROXYBENZOIC ACID

SMILES

CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)C(O)=O

InChI

InChIKey=YEXOWHQZWLCHHD-UHFFFAOYSA-N
InChI=1S/C15H22O3/c1-14(2,3)10-7-9(13(17)18)8-11(12(10)16)15(4,5)6/h7-8,16H,1-6H3,(H,17,18)

HIDE SMILES / InChI

Molecular Formula C15H22O3
Molecular Weight 250.3334
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Toxicity and effects of 2,6-di-tert-butyl-4-methylphenyl N-methylcarbamate (terbutol) on hepatic cytochrome P450 in F344 rats.
2001 Nov
Novel compounds designed as antistress agents.
2009 Nov 26
Determination of synthetic phenolic antioxidants and their metabolites in water samples by downscaled solid-phase extraction, silylation and gas chromatography-mass spectrometry.
2010 Oct 8
Patents
Substance Class Chemical
Created
by admin
on Fri Dec 15 18:32:11 GMT 2023
Edited
by admin
on Fri Dec 15 18:32:11 GMT 2023
Record UNII
9F0I7YAG34
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3,5-DI-TERT-BUTYL-4-HYDROXYBENZOIC ACID
Systematic Name English
3,5-BIS(1,1-DIMETHYLETHYL)-4-HYDROXYBENZOIC ACID
Systematic Name English
BENZOIC ACID, 3,5-BIS(1,1-DIMETHYLETHYL)-4-HYDROXY-
Common Name English
F 2 (ANTIOXIDANT)
Brand Name English
2,6-DI-TERT-BUTYL-4-CARBOXYPHENOL
Systematic Name English
4-CARBOXY-2,6-DI-TERT-BUTYLPHENOL
Systematic Name English
BENZOIC ACID, 3,5-DI-TERT-BUTYL-4-HYDROXY-
Common Name English
Code System Code Type Description
PUBCHEM
15007
Created by admin on Fri Dec 15 18:32:11 GMT 2023 , Edited by admin on Fri Dec 15 18:32:11 GMT 2023
PRIMARY
CAS
1421-49-4
Created by admin on Fri Dec 15 18:32:11 GMT 2023 , Edited by admin on Fri Dec 15 18:32:11 GMT 2023
PRIMARY
FDA UNII
9F0I7YAG34
Created by admin on Fri Dec 15 18:32:11 GMT 2023 , Edited by admin on Fri Dec 15 18:32:11 GMT 2023
PRIMARY
MESH
C062323
Created by admin on Fri Dec 15 18:32:11 GMT 2023 , Edited by admin on Fri Dec 15 18:32:11 GMT 2023
PRIMARY
ECHA (EC/EINECS)
215-823-2
Created by admin on Fri Dec 15 18:32:11 GMT 2023 , Edited by admin on Fri Dec 15 18:32:11 GMT 2023
PRIMARY
EPA CompTox
DTXSID3061683
Created by admin on Fri Dec 15 18:32:11 GMT 2023 , Edited by admin on Fri Dec 15 18:32:11 GMT 2023
PRIMARY
Related Record Type Details
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