Carbonic acid, ethyl2-propen-1-yl ester

Product Information

Molecular Formula:
C6H10 O3
Molecular Weight:
130.1418
Description
Carbonic acid, ethyl2-propen-1-yl ester is a well-known chemical compound prevalent in the biomedical sector and imparts paramount significance owing to its extensive utility. Its pivotal role lies in serving as a precursor for synthesizing diverse pharmaceutical agents, particularly those efficacious in alleviating respiratory afflictions and hypertension.
Synonyms
ALLYL ETHYL CARBONATE; CARBONIC ACID ALLYL ETHYL ESTER; (Allyloxy)formic acid ethyl ester; Carbonic acid O-allyl O-ethyl ester; Carbonic acid O-ethyl O-allyl ester; ethyl prop-2-enyl carbonate
IUPAC Name
ethyl prop-2-enyl carbonate
Canonical SMILES
CCOC(=O)OCC=C
InChI
InChI=1S/C6H10O3/c1-3-5-9-6(7)8-4-2/h3H,1,4-5H2,2H3
InChI Key
BGSFCOHRQUBESL-UHFFFAOYSA-N
Boiling Point
149 °C
Flash Point
46 °C
Purity
>97.0%(GC)
Density
0.982 g/cm3
Appearance
Colorless to Almost colorless clear liquid
Refractive Index
1.41

Safety Information

Hazards
H226:
Flammable liquid and vapour.
H315:
Causes skin irritation.
H319:
Causes serious eye irritation.
Precautionary Statement
P210:
Keep away from heat, sparks, open flames, hot surfaces. No smoking.
P264:
Wash thoroughly after handling.
P280:
Wear protective gloves/protective clothing/eye protection/face protection.
P303+P361+P353:
IF ON SKIN (or hair):
Take off immediately all contaminated clothing. [As modified by IV ATP].
Rinse skin with water/shower.
P337+P313:
If eye irritation persists:
Get medical advice/attention.
P370+P378:
In case of fire:
Use for extinction:

Computed Properties

XLogP3
1.5
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
3
Rotatable Bond Count
5
Exact Mass
130.062994177 g/mol
Monoisotopic Mass
130.062994177 g/mol
Topological Polar Surface Area
35.5Ų
Heavy Atom Count
9
Formal Charge
0
Complexity
98.5
Isotope Atom Count
0
Defined Atom Stereocenter Count
0
Undefined Atom Stereocenter Count
0
Defined Bond Stereocenter Count
0
Undefined Bond Stereocenter Count
0
Covalently-Bonded Unit Count
1
Compound Is Canonicalized
Yes

Patents

Publication Number Title Priority Date
CN-113839146-A Lithium ion battery diaphragm coated with negative active material and preparation method and application thereof 2021-09-17
US-2022077490-A1 Flame-resistant quasi-solid hybrid electrolyte for safe anode-less lithium batteries and production method 2020-09-08
US-2022069348-A1 Flame-resistant quasi-solid hybrid electrolyte for safe lithium batteries and production method 2020-09-01
CN-111799445-A Lithium metal anode and preparation and application thereof 2020-08-24
CN-111799445-B Lithium metal anode and preparation and application thereof 2020-08-24
FR-3098214-A1 MIXTURE OF LITHIUM AND POTASSIUM SALTS, AND ITS USE IN A BATTERY 2020-06-12
WO-2021222353-A1 Macrocyclic inhibitors of peptidylarginine deiminases 2020-04-30
US-2021344035-A1 Method of producing a lithium battery cell containing a non-flammable quasi-solid electrolyte 2020-04-29
US-2021344037-A1 Method and apparatus for forming a non-flammable quasi-solid electrolyte in a lithium battery 2020-04-29
US-2021344038-A1 Method of producing non-flammable quasi-solid electrolyte and a quasi-solid electrolyte/separator layer for use in a lithium battery 2020-04-29
The molarity calculator equation

Mass (g) = Concentration (mol/L) × Volume (L) × Molecular Weight (g/mol)

The dilution calculator equation

Concentration (start) × Volume (start) = Concentration (final) × Volume (final)

This equation is commonly abbreviated as: C1V1 = C2V2

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