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Details

Stereochemistry ACHIRAL
Molecular Formula C33H44O
Molecular Weight 456.7019
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2,6-Bis(1-methyl-1-phenylethyl)-4-nonylphenol

SMILES

CCCCCCCCCC1=CC(=C(O)C(=C1)C(C)(C)C2=CC=CC=C2)C(C)(C)C3=CC=CC=C3

InChI

InChIKey=SJNUIPWTKYVVGI-UHFFFAOYSA-N
InChI=1S/C33H44O/c1-6-7-8-9-10-11-14-19-26-24-29(32(2,3)27-20-15-12-16-21-27)31(34)30(25-26)33(4,5)28-22-17-13-18-23-28/h12-13,15-18,20-25,34H,6-11,14,19H2,1-5H3

HIDE SMILES / InChI

Molecular Formula C33H44O
Molecular Weight 456.7019
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 19:52:46 GMT 2023
Edited
by admin
on Sat Dec 16 19:52:46 GMT 2023
Record UNII
W25UA8SBN5
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2,6-Bis(1-methyl-1-phenylethyl)-4-nonylphenol
Systematic Name English
Phenol, 2,6-bis(1-methyl-1-phenylethyl)-4-nonyl-
Systematic Name English
Code System Code Type Description
ECHA (EC/EINECS)
287-875-4
Created by admin on Sat Dec 16 19:52:46 GMT 2023 , Edited by admin on Sat Dec 16 19:52:46 GMT 2023
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CAS
85586-70-5
Created by admin on Sat Dec 16 19:52:46 GMT 2023 , Edited by admin on Sat Dec 16 19:52:46 GMT 2023
PRIMARY
EPA CompTox
DTXSID70234799
Created by admin on Sat Dec 16 19:52:46 GMT 2023 , Edited by admin on Sat Dec 16 19:52:46 GMT 2023
PRIMARY
FDA UNII
W25UA8SBN5
Created by admin on Sat Dec 16 19:52:46 GMT 2023 , Edited by admin on Sat Dec 16 19:52:46 GMT 2023
PRIMARY
PUBCHEM
3020831
Created by admin on Sat Dec 16 19:52:46 GMT 2023 , Edited by admin on Sat Dec 16 19:52:46 GMT 2023
PRIMARY