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Details

Stereochemistry ACHIRAL
Molecular Formula C26H42O4
Molecular Weight 418.6093
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of OCTADECYL HYDROGEN PHTHALATE

SMILES

CCCCCCCCCCCCCCCCCCOC(=O)C1=C(C=CC=C1)C(O)=O

InChI

InChIKey=GXXNMQBOGJLFAY-UHFFFAOYSA-N
InChI=1S/C26H42O4/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-22-30-26(29)24-21-18-17-20-23(24)25(27)28/h17-18,20-21H,2-16,19,22H2,1H3,(H,27,28)

HIDE SMILES / InChI

Molecular Formula C26H42O4
Molecular Weight 418.6093
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 13:18:39 GMT 2023
Edited
by admin
on Sat Dec 16 13:18:39 GMT 2023
Record UNII
K5319YP21S
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
OCTADECYL HYDROGEN PHTHALATE
Systematic Name English
1,2-BENZENEDICARBOXYLIC ACID, 1-OCTADECYL ESTER
Systematic Name English
1-OCTADECYL 1,2-BENZENEDICARBOXYLATE
Systematic Name English
HYDROGEN OCTADECYL PHTHALATE
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
241-227-7
Created by admin on Sat Dec 16 13:18:39 GMT 2023 , Edited by admin on Sat Dec 16 13:18:39 GMT 2023
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PUBCHEM
86978
Created by admin on Sat Dec 16 13:18:39 GMT 2023 , Edited by admin on Sat Dec 16 13:18:39 GMT 2023
PRIMARY
CAS
17181-26-9
Created by admin on Sat Dec 16 13:18:39 GMT 2023 , Edited by admin on Sat Dec 16 13:18:39 GMT 2023
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FDA UNII
K5319YP21S
Created by admin on Sat Dec 16 13:18:39 GMT 2023 , Edited by admin on Sat Dec 16 13:18:39 GMT 2023
PRIMARY
EPA CompTox
DTXSID20169168
Created by admin on Sat Dec 16 13:18:39 GMT 2023 , Edited by admin on Sat Dec 16 13:18:39 GMT 2023
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