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Details

Stereochemistry RACEMIC
Molecular Formula C27H48O
Molecular Weight 388.6694
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 4-(1,1-DIMETHYLETHYL)-2-METHYL-6-(1-METHYLPENTADECYL)PHENOL

SMILES

CCCCCCCCCCCCCCC(C)C1=C(O)C(C)=CC(=C1)C(C)(C)C

InChI

InChIKey=LALMYSXJJWCRDR-UHFFFAOYSA-N
InChI=1S/C27H48O/c1-7-8-9-10-11-12-13-14-15-16-17-18-19-22(2)25-21-24(27(4,5)6)20-23(3)26(25)28/h20-22,28H,7-19H2,1-6H3

HIDE SMILES / InChI

Molecular Formula C27H48O
Molecular Weight 388.6694
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Patents

Patents

Substance Class Chemical
Created
by admin
on Mon Mar 31 22:49:08 GMT 2025
Edited
by admin
on Mon Mar 31 22:49:08 GMT 2025
Record UNII
W3LRK5C2R5
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
4-(1,1-DIMETHYLETHYL)-2-METHYL-6-(1-METHYLPENTADECYL)PHENOL
Systematic Name English
2-METHYL-4-TERT-BUTYL-6-(1-METHYLPENTADECYL)PHENOL
Preferred Name English
PHENOL, 4-(1,1-DIMETHYLETHYL)-2-METHYL-6-(1-METHYLPENTADECYL)-
Systematic Name English
Code System Code Type Description
FDA UNII
W3LRK5C2R5
Created by admin on Mon Mar 31 22:49:08 GMT 2025 , Edited by admin on Mon Mar 31 22:49:08 GMT 2025
PRIMARY
PUBCHEM
18961322
Created by admin on Mon Mar 31 22:49:08 GMT 2025 , Edited by admin on Mon Mar 31 22:49:08 GMT 2025
PRIMARY
CAS
157661-93-3
Created by admin on Mon Mar 31 22:49:08 GMT 2025 , Edited by admin on Mon Mar 31 22:49:08 GMT 2025
PRIMARY
EPA CompTox
DTXSID10935773
Created by admin on Mon Mar 31 22:49:08 GMT 2025 , Edited by admin on Mon Mar 31 22:49:08 GMT 2025
PRIMARY