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Details

Stereochemistry RACEMIC
Molecular Formula C45H63N3O5
Molecular Weight 725.9988
Optical Activity ( + / - )
Defined Stereocenters 0 / 3
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2,2'-(6-(4-((2-ETHYLHEXYL)OXY)PHENYL)-1,3,5-TRIAZINE-2,4-DIYL)BIS(5-((2-ETHYLHEXYL)OXY)PHENOL)

SMILES

CCCCC(CC)COC1=CC=C(C=C1)C2=NC(=NC(=N2)C3=C(O)C=C(OCC(CC)CCCC)C=C3)C4=CC=C(OCC(CC)CCCC)C=C4O

InChI

InChIKey=COAMWDBTHWZMOT-UHFFFAOYSA-N
InChI=1S/C45H63N3O5/c1-7-13-16-32(10-4)29-51-36-21-19-35(20-22-36)43-46-44(39-25-23-37(27-41(39)49)52-30-33(11-5)17-14-8-2)48-45(47-43)40-26-24-38(28-42(40)50)53-31-34(12-6)18-15-9-3/h19-28,32-34,49-50H,7-18,29-31H2,1-6H3

HIDE SMILES / InChI

Molecular Formula C45H63N3O5
Molecular Weight 725.9988
Charge 0
Count
Stereochemistry MIXED
Additional Stereochemistry No
Defined Stereocenters 0 / 3
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 17:13:12 GMT 2023
Edited
by admin
on Sat Dec 16 17:13:12 GMT 2023
Record UNII
S2Q84BPJ8N
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2,2'-(6-(4-((2-ETHYLHEXYL)OXY)PHENYL)-1,3,5-TRIAZINE-2,4-DIYL)BIS(5-((2-ETHYLHEXYL)OXY)PHENOL)
Systematic Name English
PHENOL, 2,2'-(6-(4-((2-ETHYLHEXYL)OXY)PHENYL)-1,3,5-TRIAZINE-2,4-DIYL)BIS(5-((2-ETHYLHEXYL)OXY)-
Systematic Name English
Code System Code Type Description
PUBCHEM
137127599
Created by admin on Sat Dec 16 17:13:12 GMT 2023 , Edited by admin on Sat Dec 16 17:13:12 GMT 2023
PRIMARY
FDA UNII
S2Q84BPJ8N
Created by admin on Sat Dec 16 17:13:12 GMT 2023 , Edited by admin on Sat Dec 16 17:13:12 GMT 2023
PRIMARY
CAS
1946816-71-2
Created by admin on Sat Dec 16 17:13:12 GMT 2023 , Edited by admin on Sat Dec 16 17:13:12 GMT 2023
PRIMARY