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
9NI7Q5DF3B
Record Status Validated
Record Version
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Details

Stereochemistry ACHIRAL
Molecular Formula C15H20O4
Molecular Weight 264.3169
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0
Created by admin on Wed Aug 04 06:04:14 EDT 2021
Edited by admin on Wed Aug 04 06:04:14 EDT 2021
Structure of HEXYL METHYL PHTHALATE

Systematic Names:

  • None recorded

SMILES

CCCCCCOC(=O)C1=CC=CC=C1C(=O)OC

InChI

XXLNRTDEQNSKEZ-UHFFFAOYSA-N
InChI=1S/C15H20O4/c1-3-4-5-8-11-19-15(17)13-10-7-6-9-12(13)14(16)18-2/h6-7,9-10H,3-5,8,11H2,1-2H3
Name Type Language Details Access References
HEXYL METHYL PHTHALATE
Systematic Name
English  
PHTHALIC ACID, HEXYL METHYL ESTER
Common Name
English  
NSC-409987
Code
English  
1,2-BENZENEDICARBOXYLIC ACID, HEXYL METHYL ESTER
Common Name
English  
1,2-BENZENEDICARBOXYLIC ACID, 1-HEXYL 2-METHYL ESTER
Common Name
English  
Code System Code Type Description Access References
CAS
3461-23-2
Created by admin on Wed Aug 04 06:04:14 EDT 2021 , Edited by admin on Wed Aug 04 06:04:14 EDT 2021
PRIMARY
EPA CompTox
3461-23-2
Created by admin on Wed Aug 04 06:04:14 EDT 2021 , Edited by admin on Wed Aug 04 06:04:14 EDT 2021
PRIMARY
FDA UNII
9NI7Q5DF3B
Created by admin on Wed Aug 04 06:04:14 EDT 2021 , Edited by admin on Wed Aug 04 06:04:14 EDT 2021
PRIMARY
PUBCHEM
101393
Created by admin on Wed Aug 04 06:04:14 EDT 2021 , Edited by admin on Wed Aug 04 06:04:14 EDT 2021
PRIMARY
Created Wed Aug 04 06:04:14 EDT 2021
Created By admin
Last Edited Wed Aug 04 06:04:14 EDT 2021
Last Edited By admin
Index Source Text / Citation Source Type Tags Date Accessed File Access
1 dump-public-2021-07-22_UPDATED.gsrs BATCH_IMPORT Wed Aug 04 06:04:14 EDT 2021
2 SRS import [9NI7Q5DF3B] SRS NOMEN Fri Apr 28 14:55:21 EDT 2017
3 WEBSITE WEBSITE NOMEN PUBLIC_DOMAIN_RELEASE
4 CHEMID CHEMID NOMEN
5 STN SRS NOMEN
6 STN STN (SCIFINDER)
7 SRS CODE IMPORT SRS NOMEN Fri Apr 28 14:55:21 EDT 2017
8 CHEMID SRS NOMEN PUBLIC_DOMAIN_RELEASE AUTO_SELECTED

Molecular Formula C15H20O4
Molecular Weight 264.3169
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE