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MFCD00144928 molecular structure
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(15N1)diazooxidane

ChemBase ID: 136524
Molecular Formular: N2O
Molecular Mass: 45.0062089
Monoisotopic Mass: 44.99809752
SMILES and InChIs

SMILES:
N#[15N+][O-]
Canonical SMILES:
[O-][15N+]#N
InChI:
InChI=1S/N2O/c1-2-3/i2+1
InChIKey:
GQPLMRYTRLFLPF-VQEHIDDOSA-N

Cite this record

CBID:136524 http://www.chembase.cn/molecule-136524.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
(15N1)diazooxidane
IUPAC Traditional name
(15N1)diazooxidane
Synonyms
Dinitrogen-1-15N monoxide
Laughing gas-1-15N
Nitrous-1-15N oxide
MDL Number
MFCD00144928
PubChem SID
162230794
PubChem CID
71309886

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
Sigma Aldrich
739251 external link Add to cart Please log in.
Data Source Data ID
PubChem 71309886 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) -0.0214  LogD (pH = 7.4) -0.0214 
Log P -0.0214  Molar Refractivity 27.6727 cm3
Polarizability 2.6006408 Å3 Polar Surface Area 54.46 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Melting Point
-91 °C(lit.) expand Show data source
Boiling Point
-88 °C(lit.) expand Show data source
Mass Shift
M+1 expand Show data source
European Hazard Symbols
Oxidising Oxidising (O) expand Show data source
MSDS Link
Download expand Show data source
German water hazard class
1 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
Purity
97% (CP) expand Show data source
Isotopic Purity
98 atom % 15N expand Show data source
Mol. Weight
mol wt 44.99 by atom % calculation expand Show data source
Linear Formula
15NNO expand Show data source

DETAILS

DETAILS

Sigma Aldrich Sigma Aldrich
Sigma Aldrich - 739251 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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