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1498-42-6 molecular structure
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ethyl dichlorophosphinite

ChemBase ID: 150352
Molecular Formular: C2H5Cl2OP
Molecular Mass: 146.940261
Monoisotopic Mass: 145.94550677
SMILES and InChIs

SMILES:
CCOP(Cl)Cl
Canonical SMILES:
CCOP(Cl)Cl
InChI:
InChI=1S/C2H5Cl2OP/c1-2-5-6(3)4/h2H2,1H3
InChIKey:
PVCINRPAXRJLEP-UHFFFAOYSA-N

Cite this record

CBID:150352 http://www.chembase.cn/molecule-150352.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
ethyl dichlorophosphinite
IUPAC Traditional name
ethyl dichlorophosphinite
Synonyms
Ethyl phosphorodichloridite
Ethyl dichlorophosphite
Ethyl dichlorophosphite
Ethyl phosphorodichloridite
二氯亚磷酸乙酯
乙基二氯磷酸酯
CAS Number
1498-42-6
EC Number
216-098-5
MDL Number
MFCD00000525
Beilstein Number
1697483
PubChem SID
162244513
24851831
PubChem CID
73905

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 73905 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 2.134  LogD (pH = 7.4) 2.134 
Log P 2.134  Molar Refractivity 30.9041 cm3
Polarizability 11.745915 Å3 Polar Surface Area 9.23 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Boiling Point
117-118 °C(lit.) expand Show data source
117-118°C expand Show data source
Flash Point
39.2 °F expand Show data source
4 °C expand Show data source
4°C(39°F) expand Show data source
Density
1.284 expand Show data source
1.286 g/mL at 25 °C(lit.) expand Show data source
Refractive Index
1.4660 expand Show data source
n20/D 1.464(lit.) expand Show data source
Storage Warning
Moisture Sensitive expand Show data source
European Hazard Symbols
Corrosive Corrosive (C) expand Show data source
Flammable Flammable (F) expand Show data source
UN Number
2924 expand Show data source
UN2924 expand Show data source
MSDS Link
Download expand Show data source
German water hazard class
3 expand Show data source
Hazard Class
3 expand Show data source
Packing Group
2 expand Show data source
II expand Show data source
Risk Statements
11-34 expand Show data source
Safety Statements
16-26-27-36/37/39-45 expand Show data source
16-26-36/37/39-45 expand Show data source
TSCA Listed
expand Show data source
GHS Pictograms
GHS02 expand Show data source
GHS05 expand Show data source
GHS Signal Word
Danger expand Show data source
GHS Hazard statements
H225-H314 expand Show data source
H225-H314-H318 expand Show data source
GHS Precautionary statements
P210-P241-P303+P361+P353-P305+P351+P338-P405-P501A expand Show data source
P210-P280-P305 + P351 + P338-P310 expand Show data source
Personal Protective Equipment
Faceshields, full-face respirator (US), Gloves, Goggles, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter expand Show data source
RID/ADR
UN 2924 3/PG 2 expand Show data source
Storage Temperature
2-8°C expand Show data source
Purity
98% expand Show data source
Linear Formula
C2H5OPCl2 expand Show data source

DETAILS

DETAILS

Sigma Aldrich Sigma Aldrich
Sigma Aldrich - 197475 external link
Packaging
10 g in glass bottle

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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