Home > Compound List > Compound details
23911-25-3 molecular structure
click picture or here to close

4-[2-(2,6-dioxomorpholin-4-yl)ethyl]morpholine-2,6-dione

ChemBase ID: 124698
Molecular Formular: C10H12N2O6
Molecular Mass: 256.21208
Monoisotopic Mass: 256.06953611
SMILES and InChIs

SMILES:
O1C(=O)CN(CC1=O)CCN1CC(=O)OC(=O)C1
Canonical SMILES:
O=C1CN(CCN2CC(=O)OC(=O)C2)CC(=O)O1
InChI:
InChI=1S/C10H12N2O6/c13-7-3-11(4-8(14)17-7)1-2-12-5-9(15)18-10(16)6-12/h1-6H2
InChIKey:
POLIXZIAIMAECK-UHFFFAOYSA-N

Cite this record

CBID:124698 http://www.chembase.cn/molecule-124698.html

Collapse All Expand All

NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
4-[2-(2,6-dioxomorpholin-4-yl)ethyl]morpholine-2,6-dione
IUPAC Traditional name
4-[2-(2,6-dioxomorpholin-4-yl)ethyl]morpholine-2,6-dione
Synonyms
4,4′-Ethylenebis(2,6-morpholinedione)
EDTA dianhydride
Ethylenediaminetetraacetic dianhydride
4,4'-(ethane-1,2-diyl)bis(morpholine-2,6-dione)
4,4′-亚乙基双(2,6-吗啉二酮)
EDTA 二酐
乙二胺四乙酸二酐
CAS Number
23911-25-3
MDL Number
MFCD00074963
PubChem SID
24860018
162219051
PubChem CID
513917

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 513917 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) -1.6154176  LogD (pH = 7.4) -1.6109658 
Log P -1.6109087  Molar Refractivity 55.9348 cm3
Polarizability 22.66995 Å3 Polar Surface Area 93.22 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Melting Point
190 °C (dec.)(lit.) expand Show data source
European Hazard Symbols
Irritant Irritant (Xi) expand Show data source
MSDS Link
Download expand Show data source
German water hazard class
3 expand Show data source
Risk Statements
36/37/38 expand Show data source
Safety Statements
26-37/39 expand Show data source
GHS Pictograms
GHS07 expand Show data source
GHS Signal Word
Warning expand Show data source
GHS Hazard statements
H315-H319-H335 expand Show data source
GHS Precautionary statements
P261-P305 + P351 + P338 expand Show data source
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves expand Show data source
Purity
98% expand Show data source
Empirical Formula (Hill Notation)
C10H12N2O6 expand Show data source

DETAILS

DETAILS

InterBioScreen InterBioScreen Sigma Aldrich Sigma Aldrich
Sigma Aldrich - 332046 external link
Packaging
10, 50 g in glass bottle

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