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13767-16-3 molecular structure
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(15N)ammonia

ChemBase ID: 135251
Molecular Formular: H3N
Molecular Mass: 18.0239289
Monoisotopic Mass: 18.02358399
SMILES and InChIs

SMILES:
[15NH3]
Canonical SMILES:
[15NH3]
InChI:
InChI=1S/H3N/h1H3/i1+1
InChIKey:
QGZKDVFQNNGYKY-OUBTZVSYSA-N

Cite this record

CBID:135251 http://www.chembase.cn/molecule-135251.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
(15N)ammonia
IUPAC Traditional name
(15N)ammonia
Synonyms
Ammonia-15N in methanol
Ammonia-15N, Solution in Methanol (1.75M)
Ammonia-15N
氨-15N 甲醇溶液
氨-15N
CAS Number
13767-16-3
MDL Number
MFCD00064507
PubChem SID
24872317
24858025
162229526
PubChem CID
107639

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 107639 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)
Melting Point
-78 °C(lit.) expand Show data source
Boiling Point
-33 °C(lit.) expand Show data source
Flash Point
11 °C expand Show data source
132 °C expand Show data source
14 °C expand Show data source
269.6 °F expand Show data source
51.8 °F expand Show data source
57.2 °F expand Show data source
Density
0.814 g/mL at 25 °C(lit.) expand Show data source
Vapor Density
0.6 (vs air) expand Show data source
Mass Shift
M+1 expand Show data source
European Hazard Symbols
Flammable Flammable (F) expand Show data source
Nature polluting Nature polluting (N) expand Show data source
Toxic Toxic (T) expand Show data source
UN Number
1005 expand Show data source
1230 expand Show data source
3286 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
Download expand Show data source
German water hazard class
1 expand Show data source
2 expand Show data source
Hazard Class
2.3 expand Show data source
3 expand Show data source
Packing Group
2 expand Show data source
Risk Statements
10-23-34-50 expand Show data source
11-23/24/25-34-39/23/24/25 expand Show data source
11-23/24/25-36/37/38-39/23/24/25 expand Show data source
Safety Statements
16-26-36/37/39-45 expand Show data source
16-26-36/37-45 expand Show data source
9-16-26-36/37/39-45-61 expand Show data source
GHS Pictograms
GHS02 expand Show data source
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
H221-H280-H314-H331-H400 expand Show data source
H225-H301 + H311 + H331-H314-H370-H400 expand Show data source
H225-H301-H311-H315-H319-H331-H370-H400 expand Show data source
GHS Precautionary statements
P210-P260-P273-P280-P301 + P310-P305 + P351 + P338 expand Show data source
P210-P261-P273-P280-P305 + P351 + P338-P310 expand Show data source
RID/ADR
UN 1005 2.3 expand Show data source
UN 1230 3/PG 2 expand Show data source
UN 3286 3/PG 2 expand Show data source
Concentration
2 M in methanol expand Show data source
7 M in methanol expand Show data source
Isotopic Purity
10 atom % 15N expand Show data source
98 atom % 15N expand Show data source
Certificate of Analysis
Download expand Show data source
Mol. Weight
mol wt 17.13 g/mol by atom % calculation expand Show data source
mol wt 18.01 by atom % calculation expand Show data source
Linear Formula
15NH3 expand Show data source
15NH3 / CH3OH expand Show data source

DETAILS

DETAILS

Sigma Aldrich Sigma Aldrich TRC TRC
Sigma Aldrich - 609331 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.
Sigma Aldrich - 299227 external link
Packaging
1, 10 L in cylinder
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.
Application
Precursor to 15N labeled products of agrochemical interest.
Sigma Aldrich - 676101 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.
Sigma Aldrich - 487953 external link
Packaging
10 L in steel cylinder
Lecture bottle with SS CGA 110/180 valve
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.
Recommended products
Stainless steel control valves Z146951, Z187224 or either of stainless steel regulators Z148504 and Z148512 and a "T"-purge valve Z151661 is recommended.

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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