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1257737-04-4 molecular structure
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bis(18O)arsoroso(18O)oxidane

ChemBase ID: 135688
Molecular Formular: As2H2O3
Molecular Mass: 205.856563
Monoisotopic Mass: 205.85632506
SMILES and InChIs

SMILES:
[18O]=[AsH][18O][AsH]=[18O]
Canonical SMILES:
[18O]=[AsH][18O][AsH]=[18O]
InChI:
InChI=1S/As2O3/c3-1-5-2-4/i3+2,4+2,5+2
InChIKey:
IKWTVSLWAPBBKU-LXJNWNNVSA-N

Cite this record

CBID:135688 http://www.chembase.cn/molecule-135688.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
bis(18O)arsoroso(18O)oxidane
IUPAC Traditional name
bis(18O)arsoroso(18O)oxidane
Synonyms
Arsenic(III) oxide-18O3
氧化砷(III)-18O3
CAS Number
1257737-04-4
MDL Number
MFCD09842718
PubChem SID
162229961
PubChem CID
71309374

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
Sigma Aldrich
678104 external link Add to cart Please log in.
Data Source Data ID
PubChem 71309374 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) 1.0684  LogD (pH = 7.4) 1.0684 
Log P 1.0684  Molar Refractivity 4.236 cm3
Polarizability 10.0024 Å3 Polar Surface Area 43.37 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Mass Shift
M+6 expand Show data source
European Hazard Symbols
Nature polluting Nature polluting (N) expand Show data source
Highly toxic Highly toxic (T+) expand Show data source
UN Number
1561 expand Show data source
MSDS Link
Download expand Show data source
German water hazard class
3 expand Show data source
Hazard Class
6.1 expand Show data source
Packing Group
2 expand Show data source
Risk Statements
45-28-34-50/53 expand Show data source
Safety Statements
53-45-60-61 expand Show data source
GHS Pictograms
GHS05 expand Show data source
GHS06 expand Show data source
GHS08 expand Show data source
GHS09 expand Show data source
GHS Signal Word
Danger expand Show data source
GHS Hazard statements
H300-H314-H350-H410 expand Show data source
GHS Precautionary statements
P201-P264-P273-P280-P301 + P310-P305 + P351 + P338 expand Show data source
RID/ADR
UN 1561 6.1/PG 2 expand Show data source
Purity
97% (CP) expand Show data source
Isotopic Purity
95 atom % 18O expand Show data source
Mol. Weight
mol wt 203.54 by atom % calculation expand Show data source
Linear Formula
As218O3 expand Show data source

DETAILS

DETAILS

Sigma Aldrich Sigma Aldrich
Sigma Aldrich - 678104 external link
Packaging
This product may be available from bulk stock and can be packaged on demand. For information on pricing, availability and packaging, please contact Stable Isotopes Customer Service.

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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