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2-dodecylbenzenesulfonic acid

Properties

Image

Occurences in reactions

MNX_ID

MNXM116688

	#reac
in my sandbox	0
in MNXref (generic)	0
in models (compartimentalized)	0

formula

C₁₈H₃₀O₃S

charge

mass

326.19157

reference

InChIKey

WBIQQQGBSDOWNP-UHFFFAOYSA-N

InChI

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

SMILES

CCCCCCCCCCCCc1ccccc1S(=O)(=O)O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:149774 chebi:149774	2-dodecylbenzenesulfonic acid 2-dodecylbenzene-1-sulfonic acid 2-dodecylbenzene-1-sulphonic acid o-dodecylbenzenesulfonic acid
hmdb:HMDB0031031	2-Dodecylbenzenesulfonic acid 2-Dodecylbenzene-1-sulfonate 2-Dodecylbenzene-1-sulphonate 2-Dodecylbenzene-1-sulphonic acid 2-Dodecylbenzenesulfonate 2-Dodecylbenzenesulphonate 2-Dodecylbenzenesulphonic acid 2-dodecylbenzene-1-sulfonic acid 2-dodecylbenzenesulfonic acid
envipath:...2e42a410551f envipathM:...2e42a410551f	compound 0281502
hmdb:HMDB31031	secondary/obsolete/fantasy identifier