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Details

Stereochemistry ACHIRAL
Molecular Formula C16H20O2
Molecular Weight 244.3288
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 2
Charge 0

SHOW SMILES / InChI
Structure of 4-TERT-BUTYLPHENYL SORBATE

SMILES

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

InChI

InChIKey=WCSBEMVDHPISKL-BSWSSELBSA-N
InChI=1S/C16H20O2/c1-5-6-7-8-15(17)18-14-11-9-13(10-12-14)16(2,3)4/h5-12H,1-4H3/b6-5+,8-7+

HIDE SMILES / InChI

Molecular Formula C16H20O2
Molecular Weight 244.3288
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 2
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 23:40:22 GMT 2025
Edited
by admin
on Mon Mar 31 23:40:22 GMT 2025
Record UNII
ND2160BHVW
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-TERT-BUTYLPHENYL SORBATE
Systematic Name English
2E,4E-HEXADIENOIC ACID, 4-(1,1-DIMETHYLETHYL)PHENYL ESTER
Preferred Name English
SORBIC ACID, P-TERT-BUTYLPHENYL ESTER
Common Name English
Code System Code Type Description
PUBCHEM
118796430
Created by admin on Mon Mar 31 23:40:22 GMT 2025 , Edited by admin on Mon Mar 31 23:40:22 GMT 2025
PRIMARY
CAS
101429-47-4
Created by admin on Mon Mar 31 23:40:22 GMT 2025 , Edited by admin on Mon Mar 31 23:40:22 GMT 2025
NON-SPECIFIC STEREOCHEMISTRY
FDA UNII
ND2160BHVW
Created by admin on Mon Mar 31 23:40:22 GMT 2025 , Edited by admin on Mon Mar 31 23:40:22 GMT 2025
PRIMARY
CAS
878542-31-5
Created by admin on Mon Mar 31 23:40:22 GMT 2025 , Edited by admin on Mon Mar 31 23:40:22 GMT 2025
PRIMARY