U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C14H26O4
Molecular Weight 258.3538
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of DIISOBUTYL ADIPATE

SMILES

CC(C)COC(=O)CCCCC(=O)OCC(C)C

InChI

InChIKey=RDOFJDLLWVCMRU-UHFFFAOYSA-N
InChI=1S/C14H26O4/c1-11(2)9-17-13(15)7-5-6-8-14(16)18-10-12(3)4/h11-12H,5-10H2,1-4H3

HIDE SMILES / InChI

Approval Year

PubMed

PubMed

TitleDatePubMed
Prediction of estrogen receptor agonists and characterization of associated molecular descriptors by statistical learning methods.
2006 Nov
Simultaneous determination of phthalates and adipates in human serum using gas chromatography-mass spectrometry with solid-phase extraction.
2010 Oct
Patents
Name Type Language
DIISOBUTYL ADIPATE
HSDB   INCI  
INCI  
Official Name English
DIISOBUTYL ADIPATE [HSDB]
Common Name English
DIISOBUTYL ADIPATE [INCI]
Common Name English
ADIPIC ACID DI-ISO-BUTYL ESTER
Systematic Name English
ADIPIC ACID, DIISOBUTYL ESTER
Common Name English
HEXANEDIOIC ACID, BIS(2-METHYLPROPYL) ESTER
Common Name English
DUB DIBA
Brand Name English
ADIPIC ACID BIS(2-METHYLPROPYL) ESTER
Systematic Name English
CRODAMOL DIBA
Brand Name English
NSC-6343
Code English
MATLUBE DIBA
Brand Name English
AEC DIISOBUTYL ADIPATE
Brand Name English
HALLTRESS DIBA SPECIAL
Brand Name English
KAK DIBA
Brand Name English
FEMA NO. 4475
Code English
HEXANEDIOIC ACID, 1,6-BIS(2-METHYLPROPYL) ESTER
Common Name English
Classification Tree Code System Code
JECFA EVALUATION DIISOBUTYL ADIPATE
Created by admin on Fri Dec 15 18:53:49 GMT 2023 , Edited by admin on Fri Dec 15 18:53:49 GMT 2023
Code System Code Type Description
FDA UNII
8OPY05ZY7S
Created by admin on Fri Dec 15 18:53:49 GMT 2023 , Edited by admin on Fri Dec 15 18:53:49 GMT 2023
PRIMARY
HSDB
345
Created by admin on Fri Dec 15 18:53:49 GMT 2023 , Edited by admin on Fri Dec 15 18:53:49 GMT 2023
PRIMARY
EPA CompTox
DTXSID9036690
Created by admin on Fri Dec 15 18:53:49 GMT 2023 , Edited by admin on Fri Dec 15 18:53:49 GMT 2023
PRIMARY
CAS
141-04-8
Created by admin on Fri Dec 15 18:53:49 GMT 2023 , Edited by admin on Fri Dec 15 18:53:49 GMT 2023
PRIMARY
PUBCHEM
8831
Created by admin on Fri Dec 15 18:53:49 GMT 2023 , Edited by admin on Fri Dec 15 18:53:49 GMT 2023
PRIMARY
JECFA MONOGRAPH
1945
Created by admin on Fri Dec 15 18:53:49 GMT 2023 , Edited by admin on Fri Dec 15 18:53:49 GMT 2023
PRIMARY
RXCUI
1363599
Created by admin on Fri Dec 15 18:53:49 GMT 2023 , Edited by admin on Fri Dec 15 18:53:49 GMT 2023
PRIMARY RxNorm
NSC
6343
Created by admin on Fri Dec 15 18:53:49 GMT 2023 , Edited by admin on Fri Dec 15 18:53:49 GMT 2023
PRIMARY
DAILYMED
8OPY05ZY7S
Created by admin on Fri Dec 15 18:53:49 GMT 2023 , Edited by admin on Fri Dec 15 18:53:49 GMT 2023
PRIMARY
SMS_ID
100000175413
Created by admin on Fri Dec 15 18:53:49 GMT 2023 , Edited by admin on Fri Dec 15 18:53:49 GMT 2023
PRIMARY
ECHA (EC/EINECS)
205-450-3
Created by admin on Fri Dec 15 18:53:49 GMT 2023 , Edited by admin on Fri Dec 15 18:53:49 GMT 2023
PRIMARY