POLY(VINYL ETHYL ETHER) CAS#: 25104-37-4; ChemWhat Code: 51627

IdentificationPhysical DataSpectra
Route of Synthesis (ROS)Safety and HazardsOther Data

Identification

Product NamePOLY(VINYL ETHYL ETHER)
IUPAC Nameethenoxyethane
Molecular StructureStructure of Poly(ethyl vinyl ether) 50 app.50% in Ethanol CAS 25104-37-4 and 64-17-5
CAS Registry Number 25104-37-4
EINECS Number204-085-7
MDL NumberMFCD0008446
Beilstein Registry NumberNo data available
Synonymsethyl vinyl ethervinyl ethyl etherethylvinylether
Molecular FormulaC4H8N2S4
Molecular Weight212.38
InChIInChI=1S/C4H8N2S4/c7-3(8)5-1-2-6-4(9)10/h1-2H2,(H2,5,7,8)(H2,6,9,10)
InChI KeyAWYFNIZYMPNGAI-UHFFFAOYSA-N
Canonical SMILESC(CNC(=S)S)NC(=S)S
Patent Information
Patent IDTitlePublication Date
WO2021/51092-(2,4,5-TRIMETHYLCYCLOHEX-2-EN-1-YL)ACETALDEHYDE AND DERIVATIVES AND THEIR USE AS AROMA CHEMICALS2021
JP2021/63012METHOD FOR PRODUCING FLUOROALKYLVINYL ETHER2021
US2021/122769SILOXANE COMPOUND AND A METHOD FOR PREPARING THE SAME2021

Physical Data

AppearanceResin solution
SolubilityNo data available
Flash Point9°C
Refractive indexn20/D 1.454(lit.)
SensitivityNo data available
Melting Point, °C Solvent (Melting Point)
-115.4
-115.8
Boiling Point, °CPressure (Boiling Point), Torr
33
40760
30680
Refractive IndexWavelength (Refractive Index), nmTemperature (Refractive Index), °C
1.377558920
1.379658925
1.37658920
Density, g·cm-3Reference Temperature, °CMeasurement Temperature, °C
0.759420
0.7340
0.7533420
0.762514.517.5
Description (Association (MCS))Solvent (Association (MCS))Temperature (Association (MCS)), °CPartner (Association (MCS))
Further physical properties of the complexH2O24.85dimethyl sulfoxide
Stability constant of the complex with …CCl424.94-Fluorophenol
Association with compoundacrylonitrile, cyclohexane
Dipole moment of the complexcyclohexaneacrylonitrile
Further physical properties of the complexacrylonitrile, cyclohexane

Spectra

Description (NMR Spectroscopy)Nucleus (NMR Spectroscopy)Solvents (NMR Spectroscopy)Temperature (NMR Spectroscopy), °C Frequency (NMR Spectroscopy), MHz
Chemical shifts, Spectrum1Hbenzene-d626.84300
Spectrum1H500
Chemical shifts, Spectrum1HCD2Cl220
Spin-spin coupling constantsacetone-d6
Description (IR Spectroscopy)Solvent (IR Spectroscopy)Temperature (IR Spectroscopy), °C
Comment (IR Spectroscopy)
Spectrumambient temperature
Bands3050 – 1203 cm**(-1)
Spectrumgas3136 – 131 cm**(-1)
Spectrumsolid-253.2 – -193.23115 – 73 cm**(-1)
Description (Mass Spectrometry)Comment (Mass Spectrometry)
collisional activation
spectrummetastable ions, collisional activation
spectrumcollisional activation
ion-cyclotron resonance
Description (UV/VIS Spectroscopy)Solvent (UV/VIS Spectroscopy)Absorption Maxima (UV/VIS), nmExt./Abs. Coefficient, l·mol-1cm-1
Spectrumbenzene
Absorption maxima1961000
Absorption maximahexane1968912
UV/VIS
SpectrumH2SO4

Route of Synthesis (ROS)

Route of Synthesis (ROS) of POLY(VINYL ETHYL ETHER) CAS# 25104-37-4
Route of Synthesis (ROS) of POLY(VINYL ETHYL ETHER) CAS# 25104-37-4
ConditionsYield
With pyridine In dichloromethane at 0 – 20℃; for 18h;95%
With pyridine In dichloromethane95%
With dmap In dichloromethane at -10 – 0℃; for 8h;87%

Safety and Hazards

Pictogram(s)flameexclamation-mark
SignalDanger
GHS Hazard StatementsH225 (29%): Highly Flammable liquid and vapor [Danger Flammable liquids]
H319 (76.86%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
H335 (20.6%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
H412 (19.33%): Harmful to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]
Information may vary between notifications depending on impurities, additives, and other factors.
Precautionary Statement CodesP210, P233, P240, P241, P242, P243, P261, P264+P265, P271, P273, P280, P303+P361+P353, P304+P340, P305+P351+P338, P319, P337+P317, P370+P378, P403+P233, P403+P235, P405, and P501
(The corresponding statement to each P-code can be found at the GHS Classification page.)

Other Data

TransportationThis product has a shelf life of less than 12 months in unopened, original containers at temperature between 10-30ºC.
HS CodeNo data available
StorageThis product has a shelf life of less than 12 months in unopened, original containers at temperature between 10-30ºC.
Shelf Life12 months
Market PriceUSD
Druglikeness
Lipinski rules component
Molecular Weight72.1069
logP1.247
HBA1
HBD0
Matching Lipinski Rules4
Veber rules component
Polar Surface Area (PSA)9.23
Rotatable Bond (RotB)2
Matching Veber Rules2
Bioactivity
In vitro: Efficacy
Quantitative Results
pXParameterValue (quant)Biological Species
2.82pIC50(Anesthetic activity) 2.82mouse
Quantitative Results
1 of 2Assay DescriptionPartition coefficient of the compound in water octanol system was determined
MeasurementPartition coefficient
2 of 2Assay DescriptionPotency of the compound was determined in relation to octanol-water partition coefficient
Use Pattern
POLY(VINYL ETHYL ETHER) CAS#: 25104-37-4 Volatile
POLY(VINYL ETHYL ETHER) CAS#: 25104-37-4 Additive for adhesives.
Unstable in the presence of acids
Saponification-resistant soft resin for increasing the adhesion and flexibility of printing inks and cellulose nitrate coatings.
It is a polyvinylether resin solution that is mainly used as plasticizing soft resins for cellulose nitrate coatings. Its soft-resin character also improves adhesion in these coatings.

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