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231-956-9 molecular structure
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ChemBase ID: 135317
Molecular Formular: O2
Molecular Mass: 31.98982924
Monoisotopic Mass: 31.98982924
SMILES and InChIs

SMILES:
[16O]=[16O]
Canonical SMILES:
[16O]=[16O]
InChI:
InChI=1S/O2/c1-2/i1+0,2+0
InChIKey:
MYMOFIZGZYHOMD-ZCWHFVSRSA-N

Cite this record

CBID:135317 http://www.chembase.cn/molecule-135317.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
Synonyms
Oxygen-16O2
氧气-16O2
EC Number
231-956-9
MDL Number
MFCD00167448
PubChem SID
162229591
PubChem CID
11170911

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
Sigma Aldrich
602930 external link Add to cart Please log in.
Data Source Data ID
PubChem 11170911 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) -0.27723172  LogD (pH = 7.4) -0.27723172 
Log P -0.27723172  Molar Refractivity 2.8858 cm3
Polarizability 1.478656 Å3 Polar Surface Area 34.14 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Mass Shift
depleted expand Show data source
RTECS
RS2060000 expand Show data source
European Hazard Symbols
Oxidising Oxidising (O) expand Show data source
UN Number
1072 expand Show data source
MSDS Link
Download expand Show data source
German water hazard class
nwg expand Show data source
Hazard Class
2.2 expand Show data source
Risk Statements
8 expand Show data source
GHS Pictograms
GHS03 expand Show data source
GHS04 expand Show data source
GHS Signal Word
Danger expand Show data source
GHS Hazard statements
H270-H280 expand Show data source
GHS Precautionary statements
P220-P410 + P403 expand Show data source
Personal Protective Equipment
Eyeshields, Gloves, half-mask respirator (US), multi-purpose combination respirator cartridge (US) expand Show data source
RID/ADR
UN 1072 2.2 expand Show data source
Isotopic Purity
99.98 atom % 16O expand Show data source
Linear Formula
16O2 expand Show data source

DETAILS

DETAILS

Sigma Aldrich Sigma Aldrich
Sigma Aldrich - 602930 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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