4-Decylbenzenesulfonic acid
Basic information
- CAS
140-60-3- Standard SMILES
CCCCCCCCCCc1ccc(S(=O)(=O)O)cc1- InChIKey
UASQKKHYUPBQJR-UHFFFAOYSA-N- Molecular formula
- C16H26O3S
- Average molar mass
- 298.4 g/mol
- Monoisotopic mass
- 298.16026586
Names & identifiers
- Preferred name
- 4-Decylbenzenesulfonic acid
- IUPAC
- 4-decylbenzenesulfonic acid
- English name
- p-decylbenzenesulphonic acid
- Molecular formula
- C16H26O3S
- Molecular weight
- 298.44
Names & synonyms
4-DECYLBENZENESULFONIC ACIDp-Decylbenzenesulfonic acid140-60-3Benzenesulfonic acid, 4-decyl-p-N-DecylbenzenesulfonateBenzenesulfonic acid, p-decyl-HSDB 56313A46YTI174EINECS 205-422-0DTXSID70596964-DECYLBENZENESULFONIC ACID [HSDB]pNDecylbenzenesulfonate
Show more names
p-DecylbenzolsulfonsaureP-DECYLBENZENESULFONICACID4-DECYLBENZENESULFONIC ACID)PARA-DECYLBENZENESULPHONICACID
pDecylbenzenesulfonic acidRefChem:522492Benzenesulfonic acid, pdecylBenzenesulfonic acid, 4decylDTXCID2034542p-Decylbenzenesulphonic acidUNII-3A46YTI1744-Decylbenzene-1-sulfonic acid
Database identifiers
- CAS
140-60-3- PubChem CID
- 8812
- DTXSID
DTXSID7059696- UNII
- 3A46YTI174
- EC Number
- 205-422-0
- Nikkaji
- J181.006E
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 62.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 10
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 324
Experimental & physicochemical properties
Chemical ClassesOther Classes -> Benzenesulfonic Acid Derivatives
SurfactantsSurfactant
Physicochemical properties
- CAS DataBase Reference
- 140 · 140-60-3
- FDA UNII
- 3 A46YTI174 · 3A46YTI174
- EPA Substance Registry System
- 4 · Benzenesulfonic acid, 4-decyl- (140-60-3)
- TSCA
- TSCA listed
- Hazardous Substances Data
- 140 · 140-60-3(Hazardous Substances Data)
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationBenzenesulfonic acid, 4-decyl-: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
Hazards Summary1% solutions are mildly irritating; Not skin sensitizers; No serious injuries after ingestion reported; [Reference #1]
Safety & protection
Disposal Methods
SRP: At the time of review, criteria for land treatment or burial (sanitary landfill) disposal practices are subject to significant revision. Prior to implementing land disposal of waste residue (including waste sludge), consult with environmental regulatory agencies for guidance on acceptable disposal practices.
Safety data
- tsca
- TSCA listed
- Hazardous Substances Data
- 140-60-3(Hazardous Substances Data)
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBenzenesulfonic acid, 4-decyl-: INACTIVE
Suppliers
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Related reactions
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Compound notes
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