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Details

Stereochemistry RACEMIC
Molecular Formula C12H27NO2.C8H19O4P
Molecular Weight 427.5561
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of N-CAPRYLYLDIETHANOLAMINE 2-ETHYLHEXYLPHOSPHATE

SMILES

CCCCC(CC)COP(O)(O)=O.CCCCCCCCN(CCO)CCO

InChI

InChIKey=PZBPNHIETMORBR-UHFFFAOYSA-N
InChI=1S/C12H27NO2.C8H19O4P/c1-2-3-4-5-6-7-8-13(9-11-14)10-12-15;1-3-5-6-8(4-2)7-12-13(9,10)11/h14-15H,2-12H2,1H3;8H,3-7H2,1-2H3,(H2,9,10,11)

HIDE SMILES / InChI

Molecular Formula C12H27NO2
Molecular Weight 217.3483
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C8H19O4P
Molecular Weight 210.2078
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 09:56:49 GMT 2023
Edited
by admin
on Sat Dec 16 09:56:49 GMT 2023
Record UNII
832TI1PH0V
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
N-CAPRYLYLDIETHANOLAMINE 2-ETHYLHEXYLPHOSPHATE
Systematic Name English
2,2'-(OCTYLAZANEDIYL)BIS(ETHAN-1-OL) 2-ETHYLHEXYL PHOSPHATE
Systematic Name English
Code System Code Type Description
FDA UNII
832TI1PH0V
Created by admin on Sat Dec 16 09:56:49 GMT 2023 , Edited by admin on Sat Dec 16 09:56:49 GMT 2023
PRIMARY
PUBCHEM
139033534
Created by admin on Sat Dec 16 09:56:49 GMT 2023 , Edited by admin on Sat Dec 16 09:56:49 GMT 2023
PRIMARY