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1498-40-4 molecular structure
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dichloro(ethyl)phosphane

ChemBase ID: 137605
Molecular Formular: C2H5Cl2P
Molecular Mass: 130.940861
Monoisotopic Mass: 129.95059215
SMILES and InChIs

SMILES:
CCP(Cl)Cl
Canonical SMILES:
CCP(Cl)Cl
InChI:
InChI=1S/C2H5Cl2P/c1-2-5(3)4/h2H2,1H3
InChIKey:
JHNJGLVSPIMBLD-UHFFFAOYSA-N

Cite this record

CBID:137605 http://www.chembase.cn/molecule-137605.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
dichloro(ethyl)phosphane
IUPAC Traditional name
phosphonous dichloride, ethyl-
Synonyms
Ethylphosphorous dichloride
Ethyldichlorophosphine
Dichloroethylphosphine
乙基二氯化磷
二氯化乙膦
CAS Number
1498-40-4
EC Number
216-096-4
MDL Number
MFCD00013617
PubChem SID
162231867
24860432
PubChem CID
15157

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
Sigma Aldrich
336858 external link Add to cart Please log in.
Data Source Data ID
PubChem 15157 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 1.7028  LogD (pH = 7.4) 1.7028 
Log P 1.7028  Molar Refractivity 28.0839 cm3
Polarizability 10.9360485 Å3 Polar Surface Area 0.0 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Boiling Point
112 °C(lit.) expand Show data source
Flash Point
33 °C expand Show data source
91.4 °F expand Show data source
Density
1.26 g/mL at 25 °C(lit.) expand Show data source
Refractive Index
n20/D 1.495(lit.) expand Show data source
RTECS
TB2465000 expand Show data source
European Hazard Symbols
Corrosive Corrosive (C) expand Show data source
Flammable Flammable (F) expand Show data source
UN Number
2845 expand Show data source
MSDS Link
Download expand Show data source
German water hazard class
3 expand Show data source
Hazard Class
4.2 expand Show data source
Packing Group
1 expand Show data source
Risk Statements
14-17-34 expand Show data source
Safety Statements
6-26-36/37/39-43-45 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
H226-H250-H314 expand Show data source
GHS Precautionary statements
P222-P231-P280-P305 + P351 + P338-P310-P422 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 2845 4.2/PG 1 expand Show data source
Supplemental Hazard Statements
Reacts violently with water. expand Show data source
Purity
95% expand Show data source
Linear Formula
C2H5PCl2 expand Show data source

DETAILS

DETAILS

Sigma Aldrich Sigma Aldrich
Sigma Aldrich - 336858 external link
Packaging
5, 25 g in glass bottle
Application
Catalyst in palladium-catalyzed Suzuki-Miyaura cross-coupling1

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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