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Details

Stereochemistry ACHIRAL
Molecular Formula C18H30O3S.C2H7NO
Molecular Weight 387.577
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ETHANOLAMINE O-DODECYLBENZENESULFONATE

SMILES

NCCO.CCCCCCCCCCCCC1=C(C=CC=C1)S(O)(=O)=O

InChI

InChIKey=VHGFAEBHLBZCIX-UHFFFAOYSA-N
InChI=1S/C18H30O3S.C2H7NO/c1-2-3-4-5-6-7-8-9-10-11-14-17-15-12-13-16-18(17)22(19,20)21;3-1-2-4/h12-13,15-16H,2-11,14H2,1H3,(H,19,20,21);4H,1-3H2

HIDE SMILES / InChI

Molecular Formula C18H30O3S
Molecular Weight 326.494
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C2H7NO
Molecular Weight 61.0831
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Record UNII
148OJ4YYQA
Record Status Validated (UNII)
Record Version