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Details

Stereochemistry ACHIRAL
Molecular Formula C25H32O4
Molecular Weight 396.5192
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 8-Methylnonyl phenylmethyl phthalate

SMILES

CC(C)CCCCCCCOC(=O)C1=CC=CC=C1C(=O)OCC2=CC=CC=C2

InChI

InChIKey=JEDQSFKWKKVGLW-UHFFFAOYSA-N
InChI=1S/C25H32O4/c1-20(2)13-7-4-3-5-12-18-28-24(26)22-16-10-11-17-23(22)25(27)29-19-21-14-8-6-9-15-21/h6,8-11,14-17,20H,3-5,7,12-13,18-19H2,1-2H3

HIDE SMILES / InChI

Molecular Formula C25H32O4
Molecular Weight 396.5192
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 11:49:08 GMT 2023
Edited
by admin
on Sat Dec 16 11:49:08 GMT 2023
Record UNII
LDZ85Q395H
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
8-Methylnonyl phenylmethyl phthalate
Systematic Name English
1,2-Benzenedicarboxylic acid, 1-(8-methylnonyl) 2-(phenylmethyl) ester
Systematic Name English
1,2-Benzenedicarboxylic acid, 8-methylnonyl phenylmethyl ester
Systematic Name English
Isodecyl alcohol, benzyl phthalate
Systematic Name English
1-(8-Methylnonyl) 2-(phenylmethyl) 1,2-benzenedicarboxylate
Systematic Name English
Code System Code Type Description
EPA CompTox
DTXSID80234629
Created by admin on Sat Dec 16 11:49:08 GMT 2023 , Edited by admin on Sat Dec 16 11:49:08 GMT 2023
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FDA UNII
LDZ85Q395H
Created by admin on Sat Dec 16 11:49:08 GMT 2023 , Edited by admin on Sat Dec 16 11:49:08 GMT 2023
PRIMARY
ECHA (EC/EINECS)
287-156-5
Created by admin on Sat Dec 16 11:49:08 GMT 2023 , Edited by admin on Sat Dec 16 11:49:08 GMT 2023
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CAS
85409-84-3
Created by admin on Sat Dec 16 11:49:08 GMT 2023 , Edited by admin on Sat Dec 16 11:49:08 GMT 2023
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PUBCHEM
3020703
Created by admin on Sat Dec 16 11:49:08 GMT 2023 , Edited by admin on Sat Dec 16 11:49:08 GMT 2023
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