Sodium decyl sulfate supplier

Name
SODIUM DECYL SULFATE
EINECS 205-568-5
CAS No. 142-87-0
Article Data5
CAS DataBase
Density 1.209[at 20℃]
Solubility
Melting Point 192°C(lit.)
Formula C₁₀H₂₂O₄S.Na
Boiling Point
Molecular Weight 260.33
Flash Point
Transport Information
Appearance white solid
Safety 26-36/37/39
Risk Codes 22-38-41
Molecular Structure
Hazard Symbols Xn
Synonyms Decylsodium sulfate (6CI);Sulfuric acid, monodecyl ester, sodium salt (8CI,9CI);Avirol 110;Compound 132D;DSS (surfactant);Decyl sulfate sodium salt;Emal 3F;Pentrone DN;Polystep B 25;Sodium decyl sulfate;Sodiumhydrogen sulfate decyl ester;Sodium n-decyl sulfate;Sulfochem NADS;Sulfotex110;Sulfuric acid, monodecyl ester, sodium salt;
PSA 74.81000
LogP 3.68470

Synthetic route

: 112-30-1
1-Decanol

: 142-87-0
Sulfuric acid, monodecyl ester, sodium salt

Conditions

Conditions	Yield
With sodium hydroxide; chlorosulphuric acid 1.) ether, 20 deg C, 2.) up to pH 8; Multistep reaction;
With chlorosulfonic acid; sodium hydroxide 1>) 30 min, 5 deg C, CH2Cl2; Multistep reaction;
With sulfur trioxide In trifluoroacetic acid-methyl ester
With sulfur trioxide In Methyl trichloroacetate
Stage #1: 1-Decanol With pyridine; aminosulfonic acid at 95℃; for 16h; Microwave irradiation; Stage #2: With sodium carbonate In methanol; water at 20℃; for 0.5h; Stage #3: With sodium sulfate In methanol; water at 20℃; for 0.333333h;

β-cyclodextrin, 1:1 complex with NaSO4C10H21: β-cyclodextrin, 1:1 complex with NaSO4C10H21

A: 142-87-0
Sulfuric acid, monodecyl ester, sodium salt

B β-cyclodextrin: β-cyclodextrin

Conditions

Conditions	Yield
In water at 25℃; Equilibrium constant; dissociation;

: C44H84N4(2+)*2Br(1-)

: 142-87-0
Sulfuric acid, monodecyl ester, sodium salt

: C44H84N4(2+)*2C10H21O4S(1-)

Conditions

Conditions	Yield
In methanol; dichloromethane at 20℃; for 1h;	73%

: C64H95N2O6S(1+)*I(1-)

: 142-87-0
Sulfuric acid, monodecyl ester, sodium salt

: C64H95N2O6S(1+)*C10H21O4S(1-)

Conditions

Conditions	Yield
In methanol at 60℃; for 2h;	72%

: C48H92N4(2+)*2Br(1-)

: 142-87-0
Sulfuric acid, monodecyl ester, sodium salt

: C48H92N4(2+)*2C10H21O4S(1-)

Conditions

Conditions	Yield
In methanol; dichloromethane at 20℃; for 1h;	52%

: 1,6-bis(1'-tetradecylimidazolium-3'-yl)hexane dibromide

: 142-87-0
Sulfuric acid, monodecyl ester, sodium salt

: C40H76N4(2+)*2C10H21O4S(1-)

Conditions

Conditions	Yield
In methanol; dichloromethane at 20℃; for 1h;	49%

: 142-87-0
Sulfuric acid, monodecyl ester, sodium salt

: 112-30-1
1-Decanol

Conditions

Conditions	Yield
With water-d2 at 50 - 105℃; Kinetics; variation of pH;

: 142-87-0
Sulfuric acid, monodecyl ester, sodium salt

β-cyclodextrin: β-cyclodextrin

β-cyclodextrin, 1:1 complex with NaSO4C10H21: β-cyclodextrin, 1:1 complex with NaSO4C10H21

Conditions

Conditions	Yield
In water at 25℃; Equilibrium constant; Thermodynamic data; association;

: 142-87-0
Sulfuric acid, monodecyl ester, sodium salt

: 10042-88-3
terbium(III) chloride

: Tb(III) decylsulfate

Conditions

Conditions	Yield
In ethanol byproducts: NaCl; equimolar amts. of sodium alkylsulfate and TbCl3 were mixed at -20°C; ppt. of NaCl filtered off, filtrate evapd., dried in vacuo over P2O5; elem. anal.;

: 142-87-0
Sulfuric acid, monodecyl ester, sodium salt

: iron(II) sulfate

: Fe(C10H21OSO3)2*6H2O

Conditions

Conditions	Yield
In water (ar); stirring for 1 h at room temp.; filtration, washing (water);

: 142-87-0
Sulfuric acid, monodecyl ester, sodium salt

: iron(II) chloride

: Fe(C10H21OSO3)2*6H2O

Conditions

Conditions	Yield
In water (ar); stirring for 1 h at room temp.; filtration, washing (water);

: 142-87-0
Sulfuric acid, monodecyl ester, sodium salt

: 7732-18-5
water

: 333-18-6
1,2-diaminoethane dihydrochloride

: copper dichloride

: bis(ethylenediamine)bis(decyl sulfato)copper(II)-diaquabis(ethylenediamine)copper(II) bis(decyl sulfate)

Conditions

Conditions	Yield
In water Na decyl sulfate added to aq. soln. of CuCl2 and ethylene diamine*2HCl; pH 6-7; crystd. for 1 d; filtered; washed with distd. water; elem. anal.;

...Expand

: 142-87-0
Sulfuric acid, monodecyl ester, sodium salt

: 6156-78-1
manganese (II) acetate tetrahydrate

: 189248-23-5
2-(2-benzimidazolyl)-4,4,5,5-tetramethyl-4,5-dihydro-1H-imidazolyl-3-oxide-1-oxyl

: 2Mn(2+)*3C7H4N2C3O2N2(CH3)4(1-)*C10H21SO4(1-)=Mn2(C7H4N2C3O2N2(CH3)4)3C10H21SO4

Conditions

Conditions	Yield
In methanol soln. of ligand in CH3OH treated with 0.66 equiv. of Mn salt in CH3OH, stirred for 15 min, treated slowly with NaC10H21SO4 (0.66 equiv.) in CH3OH, pptd.; suspn. centrifuged, soln. removed, treated with CH3OH, suspn. stirred, centrifuged, solvent removed, operation repeated several times, filtered,washed (CH3OH), elem. anal.;

...Expand

: europium hydroxynitrate hydrate

: 142-87-0
Sulfuric acid, monodecyl ester, sodium salt

: 7732-18-5
water

: europium hydroxy(decylsulfate) sesquihydrate

Conditions

Conditions	Yield
In water heated at 60°C for 1-10 h in air; filtered off, washed (water), dried at40°C for 1 d, elem. anal.;

...Expand

: 2La(3+)*5OH(1-)*NO3(1-)*1.5H2O=La2(OH)5(NO3)*1.5H2O

: 142-87-0
Sulfuric acid, monodecyl ester, sodium salt

: Nd2(OH)5(decyl sulfate)*1.5H2O

Conditions

Conditions	Yield
In water Nd compd. treated with aq. soln. of ligand (1:3 molar ratio) at room temp. for 10 h with stirring; XRD;

: 142-87-0
Sulfuric acid, monodecyl ester, sodium salt

: 186043-87-8
alpha-cyclodextrin

: C10H21O4S(1-)*C36H60O30*Na(1+)

Conditions

Conditions	Yield
In water-d2 at 25℃;

: 142-87-0
Sulfuric acid, monodecyl ester, sodium salt

: 186043-87-8
alpha-cyclodextrin

: C10H21O4S(1-)*2C36H60O30*Na(1+)

Conditions

Conditions	Yield
In water-d2 at 25℃;

: 142-87-0
Sulfuric acid, monodecyl ester, sodium salt

: 7398-69-8
dimethyldiallylammonium chloride

: 1311273-84-3
diallyldimethylammonium decylsulfate

Conditions

Conditions	Yield
In water

: C62H95N2O2S(1+)*I(1-)

: 142-87-0
Sulfuric acid, monodecyl ester, sodium salt

: C62H95N2O2S(1+)*C10H21O4S(1-)

Conditions

Conditions	Yield
In 4-(dicyanomethylene)-2-methyl-6-(p-dimethylaminostyryl)-4H-pyran

: 142-87-0
Sulfuric acid, monodecyl ester, sodium salt

: 880764-36-3
cinnarizine hydrochloride

: cinnarizine 1-decyl sulfate

Conditions

Conditions	Yield
In dichloromethane; water at 20℃;

: lumefantrine hydrochloride

: 142-87-0
Sulfuric acid, monodecyl ester, sodium salt

: lumefantrine 1-decyl sulfate

Conditions

Conditions	Yield
In dichloromethane; water at 20℃; Darkness;

Sodium decyl sulfate Consensus Reports

Reported in EPA TSCA Inventory.

Sodium decyl sulfate Specification

The IUPAC name of Sulfuric acid, monodecyl ester, sodium salt is sodium decyl sulfate. With the CAS registry number 142-87-0, it is also named as Decyl sodium sulfate. The product's classification code is Drug / Therapeutic Agent. Besides, it is white solid, which should be stored in sealed, dry and cool place. It is stable and incompatible with oxidizing agents, acids. In addition, its molecular formula is C₁₀H₂₁NaO₄S and molecular weight is 260.33. This chemical can be used as an anionic surfactant in cosmetics, detergents and emulsifiers.

The other characteristics of Sulfuric acid, monodecyl ester, sodium salt can be summarized as: (1)ACD/LogP: 4.33; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.83; (4)ACD/LogD (pH 7.4): 0.83; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1.71; (8)ACD/KOC (pH 7.4): 1.71; (9)#H bond acceptors: 4; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 10; (12)Polar Surface Area: 71.98 Å²; (13)EINECS: 205-568-5.

When you are using this chemical, please be cautious about it as the following: it is harmful if swallowed. It is also irritating to skin and risk of serious damage to the eyes. In case of contact with eyes, please rinse immediately with plenty of water and seek medical advice. And you should wear suitable protective clothing, gloves and eye/face protection.

People can use the following data to convert to the molecule structure.
(1)SMILES: [Na+].[O-]S(=O)(=O)OCCCCCCCCCC
(2)InChI: InChI=1/C10H22O4S.Na/c1-2-3-4-5-6-7-8-9-10-14-15(11,12)13;/h2-10H2,1H3,(H,11,12,13);/q;+1/p-1
(3)InChIKey: XZTJQQLJJCXOLP-REWHXWOFAX
(4)Std. InChI: InChI=1S/C10H22O4S.Na/c1-2-3-4-5-6-7-8-9-10-14-15(11,12)13;/h2-10H2,1H3,(H,11,12,13);/q;+1/p-1
(5)Std. InChIKey: XZTJQQLJJCXOLP-UHFFFAOYSA-M

The toxicity data is as follows:

Organism	Test Type	Route	Reported Dose (Normalized Dose)	Effect	Source
mouse	LD50	intraperitoneal	284mg/kg (284mg/kg)	BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY) VASCULAR: REGIONAL OR GENERAL ARTERIOLAR OR VENOUS DILATION	Journal of the American Pharmaceutical Association, Scientific Edition. Vol. 42, Pg. 283, 1953.
mouse	LD50	intravenous	56mg/kg (56mg/kg)		U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#00153,
rat	LD50	oral	1950mg/kg (1950mg/kg)	BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) GASTROINTESTINAL: GASTRITIS GASTROINTESTINAL: "HYPERMOTILITY, DIARRHEA"	Journal of the American Pharmaceutical Association, Scientific Edition. Vol. 42, Pg. 283, 1953.

Product Name

SODIUM DECYL SULFATE

Synthetic route

Sodium decyl sulfate Consensus Reports

Sodium decyl sulfate Specification

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