Basic Searches
Searches without any special characters (listed below) will return items that contain the exact value(s) entered in the search field. This means that searching for "ASPIRIN CALCIUM" won't return any items that have "ASPIRIN GLYCINE CALCIUM" because the search term doesn't match exactly.
Boolean Operators
OR - searches with terms separated by " OR " will return items that contain any of the terms in the search.
Example: "ASPIRIN" OR "CALCIUM" will return items that have strings like "ASPIRIN GLYCINE" and "GLYCINE CALCIUM" because they contain at least one of the terms in the search.

AND - searches with terms separated by " AND " will return items that contain all the terms in the search.
Example: "ASPIRIN" AND "CALCIUM" won't return items that have strings "ASPIRIN GLYCINE" and "GLYCINE CALCIUM" because neither contain both terms, but it will return "ASPIRIN GLYCINE CALCIUM" because it contains both search terms.
version 2.7.1
Substance Class Chemical
Record UNII
WSL2233X3J
Record Status Validated
Record Version
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Details

Stereochemistry RACEMIC
Molecular Formula C12H20O7
Molecular Weight 276.283
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0
Created by admin on Wed Aug 04 03:19:24 EDT 2021
Edited by admin on Wed Aug 04 03:19:24 EDT 2021
Structure of 1,2-DIISOPROPYL CITRATE

Systematic Names:

  • None recorded

SMILES

CC(C)OC(=O)CC(O)(CC(O)=O)C(=O)OC(C)C

InChI

VESPYRAOFXGNOV-UHFFFAOYSA-N
InChI=1S/C12H20O7/c1-7(2)18-10(15)6-12(17,5-9(13)14)11(16)19-8(3)4/h7-8,17H,5-6H2,1-4H3,(H,13,14)
Name Type Language Details Access References
1,2-DIISOPROPYL CITRATE
Common Name
English  
1,2,3-PROPANETRICARBOXYLIC ACID, 2-HYDROXY-, 1,2-BIS(1-METHYLETHYL) ESTER
Systematic Name
English  
Code System Code Type Description Access References
CAS
101396-14-9
Created by admin on Wed Aug 04 03:19:24 EDT 2021 , Edited by admin on Wed Aug 04 03:19:24 EDT 2021
PRIMARY
EPA CompTox
101396-14-9
Created by admin on Wed Aug 04 03:19:24 EDT 2021 , Edited by admin on Wed Aug 04 03:19:24 EDT 2021
PRIMARY
FDA UNII
WSL2233X3J
Created by admin on Wed Aug 04 03:19:24 EDT 2021 , Edited by admin on Wed Aug 04 03:19:24 EDT 2021
PRIMARY
PUBCHEM
20090098
Created by admin on Wed Aug 04 03:19:24 EDT 2021 , Edited by admin on Wed Aug 04 03:19:24 EDT 2021
PRIMARY

This substance is a component of the following mixtures:

Created Wed Aug 04 03:19:24 EDT 2021
Created By admin
Last Edited Wed Aug 04 03:19:24 EDT 2021
Last Edited By admin
Index Source Text / Citation Source Type Tags Date Accessed File Access
1 STN SRS NOMEN PUBLIC_DOMAIN_RELEASE AUTO_SELECTED
2 SRS import [WSL2233X3J] SRS NOMEN Fri Apr 28 15:20:46 EDT 2017
3 PUBCHEM PUBCHEM
4 FDA_SRS SRS NOMEN
5 STN (SCIFINDER) STN (SCIFINDER) NOMEN
6 WEBSITE WEBSITE NOMEN PUBLIC_DOMAIN_RELEASE
7 dump-public-2021-07-22_UPDATED.gsrs BATCH_IMPORT Wed Aug 04 03:19:21 EDT 2021
8 SRS CODE IMPORT SRS NOMEN Fri Apr 28 15:20:46 EDT 2017
9 STN STN (SCIFINDER)

Molecular Formula C12H20O7
Molecular Weight 276.283
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )