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3767-37-1 molecular structure
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(2H3)methyl(2H2)amine

ChemBase ID: 139699
Molecular Formular: CH5N
Molecular Mass: 31.0571
Monoisotopic Mass: 31.04219917
SMILES and InChIs

SMILES:
CN
Canonical SMILES:
CN
InChI:
InChI=1S/CH5N/c1-2/h2H2,1H3
InChIKey:
BAVYZALUXZFZLV-UHFFFAOYSA-N

Cite this record

CBID:139699 http://www.chembase.cn/molecule-139699.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
(2H3)methyl(2H2)amine
IUPAC Traditional name
(2H3)methyl(2H2)amine
Synonyms
Methylamine-d5
甲胺-d5
CAS Number
3767-37-1
MDL Number
MFCD00144781
PubChem SID
162233947
24881258
PubChem CID
2723977

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
Sigma Aldrich
589888 external link Add to cart Please log in.
Data Source Data ID
PubChem 2723977 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) -3.6464596  LogD (pH = 7.4) -3.147669 
Log P -0.62545884  Molar Refractivity 9.9188 cm3
Polarizability 4.106978 Å3 Polar Surface Area 26.02 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Boiling Point
-6.3 °C(lit.) expand Show data source
Flash Point
-.4 °F expand Show data source
-18 °C expand Show data source
Mass Shift
M+5 expand Show data source
European Hazard Symbols
Highly flammable Highly flammable (F+) expand Show data source
Harmful Harmful (Xn) expand Show data source
UN Number
1061 expand Show data source
MSDS Link
Download expand Show data source
German water hazard class
2 expand Show data source
Hazard Class
2.1 expand Show data source
Risk Statements
12-20-37/38-41 expand Show data source
Safety Statements
16-26-39 expand Show data source
GHS Pictograms
GHS02 expand Show data source
GHS04 expand Show data source
GHS05 expand Show data source
GHS07 expand Show data source
GHS Signal Word
Danger expand Show data source
GHS Hazard statements
H220-H280-H315-H318-H332-H335 expand Show data source
GHS Precautionary statements
P210-P261-P280-P305 + P351 + P338-P410 + P403 expand Show data source
RID/ADR
UN 1061 2.1 expand Show data source
Isotopic Purity
99 atom % D expand Show data source
Linear Formula
CD3ND2 expand Show data source

DETAILS

DETAILS

Sigma Aldrich Sigma Aldrich
Sigma Aldrich - 589888 external link
Packaging
10 g 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.

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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