2-butyloctyl hydrogen sulfate (CHEBI:155874)

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ChEBI Name	2-butyloctyl hydrogen sulfate

ChEBI ID	CHEBI:155874

Definition	An alkyl sulfate that is the mono(2-butyloctyl) ester of sulfuric acid.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information

Download	Molfile XML SDF

Formula

C12H26O4S

Net Charge

Average Mass

266.400

Monoisotopic Mass

266.15518

InChI

InChI=1S/C12H26O4S/c1-3-5-7-8-10-12(9-6-4-2)11-16-17(13,14)15/h12H,3-11H2,1-2H3,(H,13,14,15)

InChIKey

CYEJSYGBYQRTPJ-UHFFFAOYSA-N

SMILES

O(CC(CCCCCC)CCCC)S(O)(=O)=O

Roles Classification
Chemical Role(s):	surfactant A substance which lowers the surface tension of the medium in which it is dissolved, and/or the interfacial tension with other phases, and, accordingly, is positively adsorbed at the liquid/vapour and/or at other interfaces.

ChEBI Ontology
Outgoing	2-butyloctyl hydrogen sulfate (CHEBI:155874) has functional parent 2-butyl-1-octanol (CHEBI:84235) 2-butyloctyl hydrogen sulfate (CHEBI:155874) has role surfactant (CHEBI:35195) 2-butyloctyl hydrogen sulfate (CHEBI:155874) is a alkyl sulfate (CHEBI:29281) 2-butyloctyl hydrogen sulfate (CHEBI:155874) is conjugate acid of 2-butyloctyl sulfate (CHEBI:155873)

Incoming	2-butyloctyl sulfate (CHEBI:155873) is conjugate base of 2-butyloctyl hydrogen sulfate (CHEBI:155874)

IUPAC Name

2-butyloctyl hydrogen sulfate

Synonyms	Sources
(2-butyloctyl)oxysulfonic acid	ChEBI
[(2-butyloctyl)oxy]sulfonic acid	ChEBI
sulfuric acid 2-butyloctyl ester	ChEBI

Citation	Type	Source
11772605	PubMed citation	Europe PMC

Last Modified

16 June 2020