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Details

Stereochemistry ACHIRAL
Molecular Formula C14H20O3
Molecular Weight 236.3068
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 3-(1,1-DIMETHYLETHYL)-4-HYDROXY-5-METHYLBENZENEPROPANOIC ACID

SMILES

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

InChI

InChIKey=FLZYQMOKBVFXJS-UHFFFAOYSA-N
InChI=1S/C14H20O3/c1-9-7-10(5-6-12(15)16)8-11(13(9)17)14(2,3)4/h7-8,17H,5-6H2,1-4H3,(H,15,16)

HIDE SMILES / InChI

Molecular Formula C14H20O3
Molecular Weight 236.3068
Charge 0
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 Sat Dec 16 11:10:08 UTC 2023
Edited
by admin
on Sat Dec 16 11:10:08 UTC 2023
Record UNII
86FJU8655U
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
3-(1,1-DIMETHYLETHYL)-4-HYDROXY-5-METHYLBENZENEPROPANOIC ACID
Systematic Name English
2-TERT-BUTYL-4-(2-CARBOXYETHYL)-6-METHYLPHENOL
Systematic Name English
HYDROCINNAMIC ACID, 3-TERT-BUTYL-4-HYDROXY-5-METHYL-
Systematic Name English
BENZENEPROPANOIC ACID, 3-(1,1-DIMETHYLETHYL)-4-HYDROXY-5-METHYL-
Systematic Name English
.BETA.-(3-TERT-BUTYL-4-HYDROXY-5-METHYLPHENYL)PROPIONIC ACID
Systematic Name English
Code System Code Type Description
CAS
24794-55-6
Created by admin on Sat Dec 16 11:10:08 UTC 2023 , Edited by admin on Sat Dec 16 11:10:08 UTC 2023
PRIMARY
PUBCHEM
14454686
Created by admin on Sat Dec 16 11:10:08 UTC 2023 , Edited by admin on Sat Dec 16 11:10:08 UTC 2023
PRIMARY
FDA UNII
86FJU8655U
Created by admin on Sat Dec 16 11:10:08 UTC 2023 , Edited by admin on Sat Dec 16 11:10:08 UTC 2023
PRIMARY