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Diethyl isopropenyl phosphate

HCID 319403
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Basic information

CAS
5954-28-9
Standard SMILES
C=C(C)OP(=O)(OCC)OCC
InChIKey
PSIRYXWQEOZQRA-UHFFFAOYSA-N
Molecular formula
C7H15O4P
Average molar mass
194.17 g/mol
Monoisotopic mass
194.07079595

Names & identifiers

Preferred name
Diethyl isopropenyl phosphate
IUPAC
diethyl prop-1-en-2-yl phosphate
English name
Phosphoric acid 1-methylvinyldiethyl ester
Molecular formula
C7H15O4P
Molecular weight
194.17

Names & synonyms

Diethyl isopropenyl phosphate5954-28-9diethyl prop-1-en-2-yl phosphatePhosphoric acid, diethyl isopropenyl esterPhosphoric acid 1-methylvinyldiethyl esterPhosphoric acid, diethyl 1-methylethenyl esterMFCD31568086Diethyl 1-methylvinyl phosphatePhosphoric acid diethyl ester isopropenyl esterEthyl isopropenyl phosphate, (EtO)2(C3H5O)POPhosphoric acid diethylisopropenyl esterphosphoric acid diethyl isopropenyl ester
Show more names
DiethylisopropenylphosphateIsopropenyl diethyl phosphateDiethyl isopropenyl phosphate #SCHEMBL8382242DTXSID80312835PSIRYXWQEOZQRA-UHFFFAOYSA-NNSC263544AKOS037643194

Database identifiers

CAS
5954-28-9
PubChem CID
319403
DTXSID
DTXSID80312835
Nikkaji
J109.273A

Properties

Computed structural properties

XLogP
1.4
Topological polar surface area
44.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
6
Heavy atoms
12
Formal charge
0
Complexity
180

Experimental & physicochemical properties

SpringerMaterials Properties31P nuclear magnetic resonance spectrum

Physicochemical properties

Boiling point
63 · 63-63.5 °C(Press: 2 Torr)
Density
1.0719 g/cm³ · 1.0719 g/cm³
Symbol(GHS)
2 · GHS02,GHS07
Signal word
Danger
Hazard statements
225 · H225-H226-H315-H319-H335
Precautionary statements
210 · P210-P280-P305+P351+P338
RIDADR
1993 · UN1993
HazardClass
3 · 3
Limited Quantities
5 L · 5.0 L (1.3 gallons) (liquid)
Excepted Quantities
Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

ridadr
UN1993
Signal word
Danger
Symbol(GHS)
GHS02,GHS07
hazard_class
3
Hazard statements
H225-H226-H315-H319-H335
Limited Quantities
5.0 L (1.3 gallons) (liquid)
Excepted Quantities
Max Inner Pack (30g or 30ml) and Max Outer Pack (1Kg or 1L)
Precautionary statements
P210-P280-P305+P351+P338

Chemistry & industry

Applications

UsesDiethyl Isopropenyl Phosphate can be used for fireproofing porous wallboards.

Related reactions

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Compound notes

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