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Details

Stereochemistry ACHIRAL
Molecular Formula C30H56O7
Molecular Weight 528.7614
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of TRICAPRYLYL CITRATE

SMILES

CCCCCCCCOC(=O)CC(O)(CC(=O)OCCCCCCCC)C(=O)OCCCCCCCC

InChI

InChIKey=APVVRLGIFCYZHJ-UHFFFAOYSA-N
InChI=1S/C30H56O7/c1-4-7-10-13-16-19-22-35-27(31)25-30(34,29(33)37-24-21-18-15-12-9-6-3)26-28(32)36-23-20-17-14-11-8-5-2/h34H,4-26H2,1-3H3

HIDE SMILES / InChI

Molecular Formula C30H56O7
Molecular Weight 528.7614
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

PubMed

PubMed

TitleDatePubMed
Final report on the safety assessment of acetyl triethyl citrate, acetyl tributyl citrate, acetyl trihexyl citrate, and acetyl trioctyl citrate.
2002
Patents
Substance Class Chemical
Created
by admin
on Fri Dec 15 15:29:44 GMT 2023
Edited
by admin
on Fri Dec 15 15:29:44 GMT 2023
Record UNII
BXW1GAI4TA
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TRICAPRYLYL CITRATE
INCI  
INCI  
Official Name English
TRIOCTYL CITRATE
Systematic Name English
1,2,3-PROPANETRICARBOXYLIC ACID, 2-HYDROXY-, TRIOCTYL ESTER
Common Name English
BERNEL ESTER TCC
Brand Name English
CITRIC ACID, TRIOCTYL ESTER
Common Name English
TRI-N-OCTYL CITRATE
Common Name English
TRICAPRYLYL CITRATE [INCI]
Common Name English
Code System Code Type Description
CAS
16502-99-1
Created by admin on Fri Dec 15 15:29:44 GMT 2023 , Edited by admin on Fri Dec 15 15:29:44 GMT 2023
SUPERSEDED
CAS
76414-35-2
Created by admin on Fri Dec 15 15:29:44 GMT 2023 , Edited by admin on Fri Dec 15 15:29:44 GMT 2023
PRIMARY
FDA UNII
BXW1GAI4TA
Created by admin on Fri Dec 15 15:29:44 GMT 2023 , Edited by admin on Fri Dec 15 15:29:44 GMT 2023
PRIMARY
EPA CompTox
DTXSID30167837
Created by admin on Fri Dec 15 15:29:44 GMT 2023 , Edited by admin on Fri Dec 15 15:29:44 GMT 2023
PRIMARY
RXCUI
1314421
Created by admin on Fri Dec 15 15:29:44 GMT 2023 , Edited by admin on Fri Dec 15 15:29:44 GMT 2023
PRIMARY RxNorm
DAILYMED
BXW1GAI4TA
Created by admin on Fri Dec 15 15:29:44 GMT 2023 , Edited by admin on Fri Dec 15 15:29:44 GMT 2023
PRIMARY
PUBCHEM
9828350
Created by admin on Fri Dec 15 15:29:44 GMT 2023 , Edited by admin on Fri Dec 15 15:29:44 GMT 2023
PRIMARY