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Details

Stereochemistry RACEMIC
Molecular Formula C16H22O4
Molecular Weight 278.3435
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MONO(2-ETHYLHEXYL) TEREPHTHALATE

SMILES

CCCCC(CC)COC(=O)C1=CC=C(C=C1)C(O)=O

InChI

InChIKey=HRUJAEJKCNCOGW-UHFFFAOYSA-N
InChI=1S/C16H22O4/c1-3-5-6-12(4-2)11-20-16(19)14-9-7-13(8-10-14)15(17)18/h7-10,12H,3-6,11H2,1-2H3,(H,17,18)

HIDE SMILES / InChI

Molecular Formula C16H22O4
Molecular Weight 278.3435
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 08:50:55 GMT 2023
Edited
by admin
on Sat Dec 16 08:50:55 GMT 2023
Record UNII
MRK5E97B18
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
MONO(2-ETHYLHEXYL) TEREPHTHALATE
Systematic Name English
MONO(2-ETHYLHEXYL) TEREPHTHALATE, (±)-
Systematic Name English
2-ETHYLHEXYL TEREPHTHALATE
Systematic Name English
2-ETHYLHEXYL MONOHYDROGEN TEREPHTHALATE
Systematic Name English
1,4-BENZENEDICARBOXYLIC ACID, 1-(2-ETHYLHEXYL) ESTER
Systematic Name English
Code System Code Type Description
CAS
155603-50-2
Created by admin on Sat Dec 16 08:50:55 GMT 2023 , Edited by admin on Sat Dec 16 08:50:55 GMT 2023
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FDA UNII
MRK5E97B18
Created by admin on Sat Dec 16 08:50:55 GMT 2023 , Edited by admin on Sat Dec 16 08:50:55 GMT 2023
PRIMARY
PUBCHEM
154683
Created by admin on Sat Dec 16 08:50:55 GMT 2023 , Edited by admin on Sat Dec 16 08:50:55 GMT 2023
PRIMARY
EPA CompTox
DTXSID80935240
Created by admin on Sat Dec 16 08:50:55 GMT 2023 , Edited by admin on Sat Dec 16 08:50:55 GMT 2023
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