Home > Compound List > Compound details
6163-75-3 molecular structure
click picture or here to close

dimethyl ethylphosphonate

ChemBase ID: 303811
Molecular Formular: C4H11O3P
Molecular Mass: 138.102101
Monoisotopic Mass: 138.04458084
SMILES and InChIs

SMILES:
C(C)P(=O)(OC)OC
Canonical SMILES:
CCP(=O)(OC)OC
InChI:
InChI=1S/C4H11O3P/c1-4-8(5,6-2)7-3/h4H2,1-3H3
InChIKey:
YHQMSHVVGOSZEW-UHFFFAOYSA-N

Cite this record

CBID:303811 http://www.chembase.cn/molecule-303811.html

Collapse All Expand All

NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
dimethyl ethylphosphonate
IUPAC Traditional name
dimethyl ethylphosphonate
Synonyms
Dimethyl ethylphosphonate
乙基膦酸二甲酯
CAS Number
6163-75-3
MDL Number
MFCD00065120

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
Alfa Aesar 44642 external link Add to cart
Data Source Data ID Price
Alfa Aesar
44642 external link Add to cart Please log in.
Data Source Data ID

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 0.2640678  LogD (pH = 7.4) 0.2640678 
Log P 0.2640678  Molar Refractivity 31.015 cm3
Polarizability 12.8627825 Å3 Polar Surface Area 35.53 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Apperance
Liquid expand Show data source
Boiling Point
61-62°C/6mm expand Show data source
Storage Warning
Air & Moisture Sensitive expand Show data source
European Hazard Symbols
Irritant Irritant (Xi) expand Show data source
Risk Statements
36/37/38 expand Show data source
Safety Statements
26-37 expand Show data source
TSCA Listed
expand Show data source
GHS Pictograms
GHS07 expand Show data source
GHS Hazard statements
H315-H319-H335 expand Show data source
GHS Precautionary statements
P261-P305+P351+P338-P302+P352-P321-P405-P501A expand Show data source
Purity
97% expand Show data source

DETAILS

DETAILS

REFERENCES

REFERENCES

From Suppliers Google Scholar IconGoogle Scholar PubMed iconPubMed Google Books IconGoogle Books
    No data available
  • Searching...Please wait...

PATENTS

PATENTS

PubChem iconPubChem Patent Google Patent Search IconGoogle Patent

INTERNET

INTERNET

Baidu iconBaidu google iconGoogle