Sulfuricacid, monobutyl ester supplier

Name
n-Butylsulfate
EINECS
CAS No. 15507-13-8
Article Data19
CAS DataBase
Density 1.29 g/cm³
Solubility
Melting Point
Formula C₄H₁₀O₄S
Boiling Point 97.4 °C(Press: 3 Torr)
Molecular Weight 154.187
Flash Point
Transport Information
Appearance
Safety
Risk Codes
Molecular Structure
Hazard Symbols
Synonyms Butylsulfate (6CI,7CI);Butyl hydrogen sulfate;Monobutylsulfate;n-Butyl sulfate;
PSA 71.98000
LogP 1.68670

Synthetic route

: 625-22-9
sulfuric acid dibutyl ester

: 15507-13-8
Sulfuric acid monobutyl ester

Conditions

Conditions	Yield
With sulfuric acid

: 71-36-3
butan-1-ol

: 15507-13-8
Sulfuric acid monobutyl ester

Conditions

Conditions	Yield
With sulfuric acid In 1,2-dichloro-ethane at 25℃; Thermodynamic data; ΔH(formation of product);
With chlorosulfonic acid In 1,2-dichloro-ethane at 25℃; Thermodynamic data; ΔH(formation of product);
With propylene glycol; human adrenal hydroxysteroid sulfotransferase (EC 2.8.2.2); PAPS for 0.166667h; Kinetics; Km;

: 3182-75-0
butyl-nitro-amine

: 15507-13-8
Sulfuric acid monobutyl ester

Conditions

Conditions	Yield
With sulfuric acid at 25 - 85℃; Kinetics; Mechanism; Thermodynamic data; ΔH(excit.), -ΔS(excit.);

: 7664-93-9
sulfuric acid

: 71-36-3
butan-1-ol

: 15507-13-8
Sulfuric acid monobutyl ester

: 71-36-3
butan-1-ol

fume.H2SO4: fume.H2SO4

: 15507-13-8
Sulfuric acid monobutyl ester

Conditions

Conditions	Yield
at 25℃; Equilibrium constant;

: 71-36-3
butan-1-ol

fuming sulfuric acid (20 percent SO3): fuming sulfuric acid (20 percent SO3)

: 15507-13-8
Sulfuric acid monobutyl ester

Conditions

Conditions	Yield
bei laengerem Erhitzen auf dem Wasserbad;

: 71-36-3
butan-1-ol

H2SO4 (96.7 percent ): H2SO4 (96.7 percent )

: 15507-13-8
Sulfuric acid monobutyl ester

Conditions

Conditions	Yield
at 25℃; Equilibrium constant;

: 15507-13-8
Sulfuric acid monobutyl ester

: 20039-33-2
diethoxyphosphoryl isocyanate

: 287411-39-6
C9H20NO8PS

Conditions

Conditions	Yield
In 1,4-dioxane at 15 - 20℃; for 2h; Addition;	90%

: 15507-13-8
Sulfuric acid monobutyl ester

: 109-79-5
1-butanethiol

: 544-40-1
Dibutyl sulfide

Conditions

Conditions	Yield
die alkal.Loesung des Natriumsalzes;

: 15507-13-8
Sulfuric acid monobutyl ester

: 3299-05-6
1-ethoxy-1-phenylethane

: 292638-84-7
styrene

Conditions

Conditions	Yield
under 120 Torr;

: 15507-13-8
Sulfuric acid monobutyl ester

: 109-69-3
n-Butyl chloride

Conditions

Conditions	Yield
With hydrogenchloride at 130℃; under 7355.08 Torr;

: 15507-13-8
Sulfuric acid monobutyl ester

: 132-60-5
cinchophen

: 39496-99-6
2-phenyl-quinoline-4-carboxylic acid butyl ester

: 15507-13-8
Sulfuric acid monobutyl ester

: 60538-98-9
6-methyl-2-phenylquinoline-4-carboxylic acid

: 6-methyl-2-phenyl-quinoline-4-carboxylic acid butyl ester

: 15507-13-8
Sulfuric acid monobutyl ester

: 337496-05-6
6,8-dimethyl-2-phenyl-quinoline-4-carboxylic acid

: 6,8-dimethyl-2-phenyl-quinoline-4-carboxylic acid butyl ester

: 15507-13-8
Sulfuric acid monobutyl ester

: 71-36-3
butan-1-ol

Conditions

Conditions	Yield
With sulfuric acid at 32.5℃; Equilibrium constant;

: 7647-01-0
hydrogenchloride

: 15507-13-8
Sulfuric acid monobutyl ester

: 109-69-3
n-Butyl chloride

Conditions

Conditions	Yield
at 130℃; under 7355.08 Torr;

: 15507-13-8
Sulfuric acid monobutyl ester

sodium sulfide: sodium sulfide

: 544-40-1
Dibutyl sulfide

Conditions

Conditions	Yield
die alkal.Loesung des Natriumsalzes;

: 15507-13-8
Sulfuric acid monobutyl ester

sodium sulfide: sodium sulfide

A: 109-79-5
1-butanethiol

B: 544-40-1
Dibutyl sulfide

Conditions

Conditions	Yield
bei der Destillation des Natriumsalzes;

...Expand

Sulfuricacid, monobutyl ester Specification

The Sulfuricacid, monobutyl ester, with the CAS registry number 15507-13-8, is also known as Monobutylsulfate. This chemical's molecular formula is C₄H₁₀O₄S and molecular weight is 154.18. What's more, its IUPAC name is butyl hydrogen sulfate.

Physical properties of Sulfuricacid, monobutyl ester are: (1)ACD/LogP: 1.14; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -2.36; (4)ACD/LogD (pH 7.4): -2.36; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 4; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 60.98 Å²; (13)Index of Refraction: 1.458; (14)Molar Refractivity: 32.65 cm³; (15)Molar Volume: 119.4 cm³; (16)Polarizability: 12.94×10^-24cm³; (17)Surface Tension: 45.8 dyne/cm; (18)Density: 1.29 g/cm³.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CCCCOS(=O)(=O)O
(2)InChI: InChI=1S/C4H10O4S/c1-2-3-4-8-9(5,6)7/h2-4H2,1H3,(H,5,6,7)
(3)InChIKey: ZTHQBROSBNNGPU-UHFFFAOYSA-N

Product Name

n-Butylsulfate

Synthetic route

Sulfuricacid, monobutyl ester Specification

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