HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
Huagongshe Open Program:[email protected]AI access: llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.7.8
  1. Home
  2. /Compound

Ethyl Sulfate

HCID 6004
NotesReactions
Basic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

CAS
540-82-9
Standard SMILES
CCOS(=O)(=O)O
InChIKey
KIWBPDUYBMNFTB-UHFFFAOYSA-N
Molecular formula
C2H6O4S
Average molar mass
126.13 g/mol
Monoisotopic mass
125.99867984

Overview

Alkylsulfuric acids are colorless, oily liquids. They are soluble in water and weigh more than water. Contact with the material may cause severe irritation to skin, eyes, and mucous membranes. It may be toxic by ingestion, inhalation and skin absorption. It is used to make other chemicals.

Names & identifiers

Preferred name
Ethyl Sulfate
IUPAC
ethyl hydrogen sulfate
English name
ethyl hydrogen sulphate
Molecular formula
C2H6O4S
Molecular weight
126.13

Names & synonyms

ethyl hydrogen sulfateEthyl sulfate540-82-9Monoethyl sulfateEthoxysulfonic acidSULFURIC ACID, MONOETHYL ESTERP3LK0HF3B7DTXSID10862151RefChem:921306DTXCID50197494208-758-6Sulfovinic acid
Show more names
EthylhydrogensulfatEthyl sulfate (7CI)Ethy Hydrogen SulphateGlimepiride Impurity 29Ethyl sulfate free-forMsulfuric acid ethyl esterMedidrug ALCM Urine Level 3
Sulfethylic acidEthyl hydrogen sulphateethylsulfuric acidEthylsulphuric acidEthyl sulphateSulfuric acid monoethyl esterUNII-P3LK0HF3B7Monoethyl sulphate

Database identifiers

CAS
540-82-9
PubChem CID
6004
DTXSID
DTXSID10862151
ChEBI
CHEBI:156187
UNII
P3LK0HF3B7
EC Number
208-758-6

Properties

Computed structural properties

XLogP
-0.5
Topological polar surface area
72 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
4
Rotatable bonds
2
Heavy atoms
7
Formal charge
0
Complexity
117

Experimental & physicochemical properties

Chemical ClassesCorrosives
Physical Description · 1 item

Alkylsulfuric acids are colorless, oily liquids. They are soluble in water and weigh more than water. Contact with the material may cause severe irritation to skin, eyes, and mucous membranes. It may be toxic by ingestion, inhalation and skin absorption. It is used to make other chemicals.

Physicochemical properties

Melting point
-32 °C · -32°C (estimate)
Boiling point
280 °C · 280°C
Density
1.46 g/cm3 · 1.46 g/cm3
refractive index
1.4105 · 1.4105
form
liquid (estimate)
pka
-3.14 · -3.14±0.15(Predicted)
Stability
Stable. Incompatible with strong oxidizing agents, metals
CAS DataBase Reference
540 · 540-82-9
FDA UNII
3 LK0HF3B7 · P3LK0HF3B7

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 · 5 items

This chemical does not meet GHS hazard criteria for 9.3% (4 of 43) of reports.

Danger

H315 (90.7%): Causes skin irritation [Warning Skin corrosion/irritation]

P264, P264+P265, P280, P302+P352, P305+P354+P338, P317, P321, P332+P317, and P362+P364 (click each P-code to see the statement)

Aggregated GHS information provided per 43 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Hazard information

Regulatory Information · 2 items

Sulfuric acid, monoethyl ester: 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.

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 LabelCorrosive
Fire HazardsExcerpt from ERG Guide 156 [Substances - Toxic and/or Corrosive (Combustible / Water-Sensitive)]:
Health HazardsExcerpt from ERG Guide 156 [Substances - Toxic and/or Corrosive (Combustible / Water-Sensitive)]:
Reactive GroupAcids, Strong Oxidizing
Reactivity AlertsKnown Catalytic Activity
Reactivity Profile · 1 item

Oxidizing acids are generally soluble in water with the release of hydrogen ions. The resulting solutions have pH's of less than 7.0. Materials in this group react with chemical bases (for example: amines and inorganic hydroxides) to form salts. These neutralization reactions occur as the base accepts hydrogen ions that the acid donates. Neutralizations can generate dangerously large amounts of heat in small spaces. The dissolution of acids in water or the dilution of their concentrated solutions with water may generate significant heat. The addition of water acids often generates sufficient heat in the small region of mixing to boil some of the water explosively. The resulting "bumping" spatters acid widely. These materials have significant ability as oxidizing agents. but that ability varies (for example, from high for nitric acid to low for sulfuric acid and most sulfonic acids). They can react with active metals, including iron and aluminum, and also many less active metals, to dissolve the metal and liberate hydrogen and/or toxic gases. Like other acids, materials in this group can initiate polymerization in certain classes of organic compounds. Their reactions with cyanide salts and compounds release gaseous hydrogen cyanide. Flammable and/or toxic gases are also often generated by their reactions with dithiocarbamates, isocyanates, mercaptans, nitrides, nitriles, sulfides, and weak or strong reducing agents. Additional gas-generating reactions occur with sulfites, nitrites, thiosulfates (to give H2S and SO3), dithionites (SO2), and even carbonates: the carbon dioxide gas from the last is nontoxic but the heat and spattering from the reaction can be troublesome. Acids often catalyze (increase the rate) of chemical reactions.

Chemistry & industry

Pharmacology

MeSH Pharmacological Classification · 2 items

Highly reactive chemicals that introduce alkyl radicals into biologically active molecules and thereby prevent their proper functioning. Many are used as antineoplastic agents, but most are very toxic, with carcinogenic, mutagenic, teratogenic, and immunosuppressant actions. They have also been used as components in poison gases.

Chemical agents that increase the rate of genetic mutation by interfering with the function of nucleic acids. A clastogen is a specific mutagen that causes breaks in chromosomes.

Cellular LocationsCytoplasm

Uses & manufacturing

Household ProductsInformation on 3 consumer products that contain Ethyl sulfate in the following categories is provided:
General Manufacturing InformationSulfuric acid, monoethyl ester: ACTIVE
Applications · 2 items

UsesEthyl hydrogen sulfate is used as an intermediate in the synthesis of ethanol from ethylene.

General Descriptionethyl hydrogen sulphate are colorless, oily liquids. They are soluble in water and weigh more than water. Contact with the material may cause severe irritation to skin, eyes, and mucous membranes. ethyl hydrogen sulphate may be toxic by ingestion, inhalation and skin absorption. ethyl hydrogen sulphate is used to make other chemicals.

Upstream & downstream products

Upstream raw materials

Fuming sulfuric acidFlow Cell

Related reactions

0 records
New reaction record

No reaction records under the current filter.

Compound notes

Loading…

On this pageBasic informationOverviewNames & identifiersPropertiesSafety & regulationChemistry & industryRelated reactionsCompound notes
Nikkaji
J23.996H
EPA Substance Registry System
Sulfuric acid, monoethyl ester (540-82-9)
Symbol(GHS)
5 · GHS05
Signal word
Danger
Hazard statements
315 · H315-H318
Precautionary statements
264 · P264-P280-P302+P352-P332+P313-P362+P364-P305+P351+P338-P310
RIDADR
2571 · 2571
TSCA
TSCA listed
HazardClass
8 · 8
PackingGroup
II
Air and Water ReactionsThey are soluble in water and weigh more than water. Heat may be generated by dissolution into water.
Hazard Classes and Categories · 2 items

Skin Irrit. 2 (90.7%)

Corrosives, Reactive agents - 1st degree

Safety & protection

Fire FightingExcerpt from ERG Guide 156 [Substances - Toxic and/or Corrosive (Combustible / Water-Sensitive)]:
First AidExcerpt from ERG Guide 156 [Substances - Toxic and/or Corrosive (Combustible / Water-Sensitive)]:
Nonfire Spill ResponseExcerpt from ERG Guide 156 [Substances - Toxic and/or Corrosive (Combustible / Water-Sensitive)]:
Isolation and EvacuationExcerpt from ERG Guide 156 [Substances - Toxic and/or Corrosive (Combustible / Water-Sensitive)]:
Personal Protective Equipment (PPE)Excerpt from ERG Guide 156 [Substances - Toxic and/or Corrosive (Combustible / Water-Sensitive)]:

Safety data

tsca
TSCA listed
ridadr
2571
Signal word
Danger
Symbol(GHS)
GHS05
hazard_class
8
packing_group
II
Hazard statements
H315-H318
Precautionary statements
P264-P280-P302+P352-P332+P313-P362+P364-P305+P351+P338-P310
N-hydroxy-4-chloroacetanilide
1,2-Ethanediol, bis(hydrogen sulfate)
2-Chloro-4,6-dinitroaniline
Diethyl sulfate
Ethane
O,O-Diethyl thiophosphate, potassium salt
Diethyl ether
Water
Ethanol
Ethylene
Iodoethane

Suppliers11 total

广州隽唐科技有限公司020-36607679 13502246435 · [email protected]
梯希爱(上海)化工贸易有限公司021-61109150 · [email protected]
希瓦生物科技(广州)有限公司13268215580 · [email protected]
上海嵩爰化工科技有限公司010-1234567 18521000990 · [email protected]
陕西缔都医药化工有限公司029-81024372 17792795018 · [email protected]
深圳振强药物研发有限公司+86-0755-66853366 +86-13670046396 · [email protected]
广东翁江化学试剂有限公司0751-2886766 13927870850 · [email protected]
Standardpharm Co. Ltd.86-714-3992388 · [email protected]
广东元丰化学试剂有限公司0751-2829979 13318584237 · [email protected]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
陕西缔都医药化工有限公司+86-29-87569266 +86-17392581500 · [email protected]

Additional notes

DefinitionChEBI: Ethyl hydrogen sulfate is a sulfuric ester.