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Details

Stereochemistry RACEMIC
Molecular Formula C27H46O2
Molecular Weight 402.6529
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of OCTYLDODECYL BENZOATE

SMILES

CCCCCCCCCCC(CCCCCCCC)COC(=O)C1=CC=CC=C1

InChI

InChIKey=LNRUVXAPKCPQGX-UHFFFAOYSA-N
InChI=1S/C27H46O2/c1-3-5-7-9-11-12-14-17-21-25(20-16-13-10-8-6-4-2)24-29-27(28)26-22-18-15-19-23-26/h15,18-19,22-23,25H,3-14,16-17,20-21,24H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C27H46O2
Molecular Weight 402.6529
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Patents
Substance Class Chemical
Created
by admin
on Mon Mar 31 23:38:44 GMT 2025
Edited
by admin
on Mon Mar 31 23:38:44 GMT 2025
Record UNII
R04N7AS5EA
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
FINSOLV BOD
Preferred Name English
OCTYLDODECYL BENZOATE
INCI  
INCI  
Official Name English
OCTODODECYL BENZOATE
Common Name English
2-OCTYLDODECYL BENZOATE
Systematic Name English
1-DODECANOL, 2-OCTYL-, 1-BENZOATE
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID40888829
Created by admin on Mon Mar 31 23:38:44 GMT 2025 , Edited by admin on Mon Mar 31 23:38:44 GMT 2025
PRIMARY
RXCUI
2099357
Created by admin on Mon Mar 31 23:38:44 GMT 2025 , Edited by admin on Mon Mar 31 23:38:44 GMT 2025
PRIMARY
FDA UNII
R04N7AS5EA
Created by admin on Mon Mar 31 23:38:44 GMT 2025 , Edited by admin on Mon Mar 31 23:38:44 GMT 2025
PRIMARY
CAS
108347-89-3
Created by admin on Mon Mar 31 23:38:44 GMT 2025 , Edited by admin on Mon Mar 31 23:38:44 GMT 2025
PRIMARY
DAILYMED
R04N7AS5EA
Created by admin on Mon Mar 31 23:38:44 GMT 2025 , Edited by admin on Mon Mar 31 23:38:44 GMT 2025
PRIMARY
PUBCHEM
86107
Created by admin on Mon Mar 31 23:38:44 GMT 2025 , Edited by admin on Mon Mar 31 23:38:44 GMT 2025
PRIMARY