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Details

Stereochemistry ACHIRAL
Molecular Formula C12H16O2
Molecular Weight 192.2542
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-tert-Butylphenol acetate

SMILES

CC(=O)OC1=CC=C(C=C1)C(C)(C)C

InChI

InChIKey=FSALNWWFUMHOAU-UHFFFAOYSA-N
InChI=1S/C12H16O2/c1-9(13)14-11-7-5-10(6-8-11)12(2,3)4/h5-8H,1-4H3

HIDE SMILES / InChI

Molecular Formula C12H16O2
Molecular Weight 192.2542
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 09:04:52 GMT 2023
Edited
by admin
on Sat Dec 16 09:04:52 GMT 2023
Record UNII
JGF8N2D4JB
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-tert-Butylphenol acetate
Systematic Name English
p-tert-Butylphenyl acetate
Systematic Name English
Phenol, 4-(1,1-dimethylethyl)-, acetate
Systematic Name English
Phenol, 4-(1,1-dimethylethyl)-, 1-acetate
Systematic Name English
NSC-6839
Code English
AI3-18022
Code English
Code System Code Type Description
ECHA (EC/EINECS)
221-288-6
Created by admin on Sat Dec 16 09:04:52 GMT 2023 , Edited by admin on Sat Dec 16 09:04:52 GMT 2023
PRIMARY
PUBCHEM
76463
Created by admin on Sat Dec 16 09:04:52 GMT 2023 , Edited by admin on Sat Dec 16 09:04:52 GMT 2023
PRIMARY
NSC
6839
Created by admin on Sat Dec 16 09:04:52 GMT 2023 , Edited by admin on Sat Dec 16 09:04:52 GMT 2023
PRIMARY
FDA UNII
JGF8N2D4JB
Created by admin on Sat Dec 16 09:04:52 GMT 2023 , Edited by admin on Sat Dec 16 09:04:52 GMT 2023
PRIMARY
CAS
3056-64-2
Created by admin on Sat Dec 16 09:04:52 GMT 2023 , Edited by admin on Sat Dec 16 09:04:52 GMT 2023
PRIMARY
EPA CompTox
DTXSID50883941
Created by admin on Sat Dec 16 09:04:52 GMT 2023 , Edited by admin on Sat Dec 16 09:04:52 GMT 2023
PRIMARY