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62948-80-5 molecular structure
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(15N)amine hydrate

ChemBase ID: 135253
Molecular Formular: NO
Molecular Mass: 30.9995089
Monoisotopic Mass: 30.99502352
SMILES and InChIs

SMILES:
[15NH3].O
Canonical SMILES:
[15NH3].O
InChI:
InChI=1S/H3N.H2O/h1H3;1H2/i1+1;
InChIKey:
VHUUQVKOLVNVRT-YTBWXGASSA-N

Cite this record

CBID:135253 http://www.chembase.cn/molecule-135253.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
(15N)amine hydrate
IUPAC Traditional name
(15N)amine hydrate
Synonyms
Ammonium-15N hydroxide solution
氢氧化铵-15N 溶液
CAS Number
62948-80-5
MDL Number
MFCD00084193
PubChem SID
24872322
24882014
162229528
24872077
PubChem CID
71309179

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 71309179 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) -3.7525723  LogD (pH = 7.4) -2.4393091 
Log P -0.978  Molar Refractivity 15.5149 cm3
Polarizability 2.2600515 Å3 Polar Surface Area 13.59 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Refractive Index
n20/D 1.336 expand Show data source
n20/D 1.339 expand Show data source
Mass Shift
M+1 expand Show data source
European Hazard Symbols
Corrosive Corrosive (C) expand Show data source
Nature polluting Nature polluting (N) expand Show data source
UN Number
2672 expand Show data source
MSDS Link
Download expand Show data source
Download expand Show data source
Download expand Show data source
Download expand Show data source
German water hazard class
2 expand Show data source
Hazard Class
8 expand Show data source
Packing Group
3 expand Show data source
Risk Statements
34 expand Show data source
34-50 expand Show data source
Safety Statements
26-36/37/39-45 expand Show data source
26-36/37/39-45-61 expand Show data source
GHS Pictograms
GHS05 expand Show data source
GHS07 expand Show data source
GHS09 expand Show data source
GHS Signal Word
Danger expand Show data source
GHS Hazard statements
H314-H335 expand Show data source
H314-H335-H400 expand Show data source
GHS Precautionary statements
P261-P273-P280-P305 + P351 + P338-P310 expand Show data source
P261-P280-P305 + P351 + P338-P310 expand Show data source
RID/ADR
UN 2672 8/PG 3 expand Show data source
Concentration
~14 N in H2O expand Show data source
~3 N in H2O expand Show data source
~6 N in H2O expand Show data source
Isotopic Purity
10 atom % 15N expand Show data source
98 atom % 15N expand Show data source
Mol. Weight
mol wt 35.15 by atom % calculation expand Show data source
mol wt 36.02 by atom % calculation expand Show data source
Linear Formula
15NH4OH/H2O soln. expand Show data source

DETAILS

DETAILS

Sigma Aldrich Sigma Aldrich
Sigma Aldrich - 485454 external link
Packaging
5 g in glass bottle
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.
Sigma Aldrich - 609390 external link
Packaging
5 g in glass bottle
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.
Sigma Aldrich - 488011 external link
Packaging
5, 10 g in glass bottle
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.
Sigma Aldrich - 609544 external link
Packaging
250 g in poly bottle
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

PubChem iconPubChem Patent Google Patent Search IconGoogle Patent

INTERNET

INTERNET

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