dodecylbenzenesulfonic acid, triethanolamine salt
Basic information
- CAS
27323-41-7- Standard SMILES
CCCCCCCCCCCCc1cccc(S(=O)(=O)O)c1.OCCN(CCO)CCO- InChIKey
JHWLWOYSFJIYQV-UHFFFAOYSA-N- Molecular formula
- C18H30O3S.C6H15NO3
- Average molar mass
- 475.7 g/mol
- Monoisotopic mass
- 475.29675933
Overview
This material contains triethanolamine dodecylbenzenesulfonate, a white- colored, waxy solid dissolved in a liquid carrier. The primary hazard of this material is its potential threat to the environment. Immediate steps should be taken to limit its spread to the environment. Since it is a liquid it can easily penetrate the soil and contaminate groundwater and nearby streams.
Names & identifiers
- Preferred name
- dodecylbenzenesulfonic acid, triethanolamine salt
- IUPAC
- 2-[bis(2-hydroxyethyl)amino]ethanol;3-dodecylbenzenesulfonic acid
- English name
- TRIETHANOLAMMONIUM DODECYLBENZENE SULFONATE
- Molecular formula
- C18H30O3S.C6H15NO3
- Molecular weight
- 475.682
Names & synonyms
Witconate TabTriethanolamine dodecylbenzenesulfonateWitconate 60LWitconate 60TWitconate 79STEA-DodecylbenzenesulfonateWitconate 5725Witconate S-1280Caswell No. 887AAAI3-26730-XDodecylbenzenesulfonic acid triethanolamine saltEINECS 248-406-9
Show more names
Alkasurf Twitconate60lwitconate60twitconate79switconatetabwitconate5725witconates-1280TEADODECYLBENZENESULPHONATE
EPA Pesticide Chemical Code 0790208HM7ZD48HNDodecylbenzenesulfonic acid, triethanolamine saltDodecylbenzenesulphonic acid, compound with 2,2',2''-nitrilotriethanol (1:1)DTXSID5027932BENZENESULFONIC ACID, DODECYL-, COMPOUND WITH 2,2',2"-NITRILOTRIS(ETHANOL) (1:1)BENZENESULFONIC ACID, DODECYL-, COMPOUND WITH 2,2',2"-NITRILOTRIS[ETHANOL] (1:1)Witconate S1280
Database identifiers
- CAS
27323-41-7
Properties
Computed structural properties
- Topological polar surface area
- 127 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 18
- Heavy atoms
- 32
- Formal charge
- 0
- Complexity
- 415
Experimental & physicochemical properties
Chemical ClassesOther Classes -> Benzenesulfonic Acid Derivatives
Cosmetics
Cosmetic ingredients (TEA-Dodecylbenzenesulfonate) -> CIR (Cosmetic Ingredient Review)
Foaming; Surfactant
Density1.2 at 68 °F (est.) (USCG, 1999) - Denser than water; will sink
Physical Description
This material contains triethanolamine dodecylbenzenesulfonate, a white- colored, waxy solid dissolved in a liquid carrier. The primary hazard of this material is its potential threat to the environment. Immediate steps should be taken to limit its spread to the environment. Since it is a liquid it can easily penetrate the soil and contaminate groundwater and nearby streams.
Other Solid; Liquid
White waxy solid dissolved in a liquid carrier; [CAMEO] 60% Aqueous solution: Yellowish-brown liquid; [CHRIS]
Physicochemical properties
- Stability
- Stable. Combustible. Incompatible with strong oxidizing agents.
- Cosmetics Ingredients Functions
- CLEANSINGFOAMINGSURFACTANT - CLEANSING
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
This chemical does not meet GHS hazard criteria for 10.2% (70 of 689) of reports.
Danger
H301 (15.2%): Toxic if swallowed [Danger Acute toxicity, oral]
P264, P264+P265, P270, P280, P301+P316, P301+P317, P302+P352, P305+P351+P338, P305+P354+P338, P317, P321, P330, P332+P317, P337+P317, P362+P364, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 689 reports by companies from 22 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory Information
Benzenesulfonic acid, dodecyl-, compd. with 2,2',2''-nitrilotris[ethanol] (1:1) is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Benzenesulfonic acid, dodecyl-, compd. with 2,2',2''-nitrilotris[ethanol] (1:1) are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
Benzenesulphonic acid, dodecyl-, compd. with triethanolamine (1:1): Does not have an individual approval but may be used under an appropriate group standard
The New Jersey Worker and Community Right to Know Act requires public and private employers to provide information about hazardous substances at their workplaces. (N.J.S.A. 34:5A-1 et. seq.)
DOT LabelClass 9
Fire HazardsSpecial Hazards of Combustion Products: Toxic oxides of nitrogen and irritating oxides of sulfur may form in fire. (USCG, 1999)
Health HazardsIngestion may cause irritation of mouth and stomach. Contact with eyes or prolonged contact with skin may cause irritation. (USCG, 1999)
Hazards Summary
Chemistry & industry
Uses & manufacturing
Uses
CIR ingredient: TEA-Dodecylbenzenesulfonate
Used in the chemical, agricultural, and textile processing industries; Used as an intermediate, pesticide, and surface-active agent; [IUCLID] Anionic surfactant used in household, institutional, and industrial cleaning products, emulsion polymerization (i.e. agricultural products), as dye dispersants in the textile industry, in paint strippers, specialized personal care products, and children's bubble making products; [EPA ChAMP: Submissions - Submission] Formerly registered in the US for use as a disinfectant; [NPIRS] Permitted for use as an inert ingredient in non-food pesticide products; [EPA]
Painting (Pigments, Binders, and Biocides) [Category: Paint]
U.S. Production2023: 850,000 - <1,000,000 lb
Consumer UsesSurfactant (surface active agent)
Industry UsesSurfactant (surface active agent)
Household ProductsInformation on 86 consumer products that contain TEA-dodecylbenzenesulfonate in the following categories is provided:
Use ClassificationCosmetics -> Foaming; Surfactant
General Manufacturing Information
Paper Manufacturing
Benzenesulfonic acid, dodecyl-, compd. with 2,2',2''-nitrilotris[ethanol] (1:1): ACTIVE
Applications
UsesFood additive.
General DescriptionTRIETHANOLAMMONIUM DODECYLBENZENE SULFONATE contains TRIETHANOLAMMONIUM DODECYLBENZENE SULFONATE, a white- colored, waxy solid dissolved in a liquid carrier. The primary hazard of TRIETHANOLAMMONIUM DODECYLBENZENE SULFONATE is its potential threat to the environment. Immediate steps should be taken to limit its spread to the environment. Since TRIETHANOLAMMONIUM DODECYLBENZENE SULFONATE is a liquid TRIETHANOLAMMONIUM DODECYLBENZENE SULFONATE can easily penetrate the soil and contaminate groundwater and nearby streams.
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Compound notes
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