Basic information
- Standard SMILES
CCCCCCCCCCCCCCCCCCOS(=O)(=O)O- InChIKey
HVWGGPRWKSHASF-UHFFFAOYSA-N- Molecular formula
- C18H38O4S
- Average molar mass
- 350.6 g/mol
- Monoisotopic mass
- 350.2490807
Overview
Sulfuric acid, monooctadecyl ester is a sulfuric ester.
Names & identifiers
- Preferred name
- Sulfuric acid, monooctadecyl ester
- IUPAC
- octadecyl hydrogen sulfate
- English name
- octadecyl hydrogen sulphate
- Molecular formula
- C18H38O4S
- Molecular weight
- 350.55692
Names & synonyms
Sulfuric acid, monooctadecyl esteroctadecyl hydrogen sulfateOctadecyl hydrogen sulphateOCTADECYL SULFATEstearyl sulfaten-octadecyl sulfateUNII-0K1H616V7H0K1H616V7HEINECS 205-580-0J140.476HDTXSID2042432RefChem:186684
Show more names
OctadecylsulfateOCTADECYLSULPHATEsulfuric acid stearyl esterSulfuric acid hydrogen octadecyl ester
DTXCID0022432143-03-3Sulfuric acid,monooctadecyl esteroctadecylsulfuric acidoctadecyl hydrogen sulateSCHEMBL41459monooctadecyl estersulfuric acidCHEMBL405591
Database identifiers
- CAS
143-03-3- PubChem CID
- 8912
- DTXSID
DTXSID2042432- ChEMBL
CHEMBL405591- ChEBI
CHEBI:173347- UNII
- 0K1H616V7H
- EC Number
- 205-580-0
- Nikkaji
- J140.476H
Properties
Computed structural properties
- XLogP
- 8
- Topological polar surface area
- 72 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 18
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 322
Experimental & physicochemical properties
Collision Cross Section189.8 Ų [M-H]- [CCS Type: DT; Buffer gas: N2; Ionization: ESI-; Dataset: TOXCAST; Source Identifier: DTXSID6047103]
Physicochemical properties
- FDA UNII
- 0 K1H616V7H · 0K1H616V7H
- EPA Substance Registry System
- Sulfuric acid, monooctadecyl ester (143-03-3)
- TSCA
- TSCA listed
Safety & regulation
Hazard information
Regulatory InformationChemical: Sulfuric acid, monooctadecyl ester
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationSulfuric acid, monooctadecyl ester: INACTIVE
Suppliers1 total
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Additional notes
DefinitionChEBI: Sulfuric acid, monooctadecyl ester is a sulfuric ester.
Related reactions
0 records
No reaction records under the current filter.
Linked notes
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