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MFCD00144138 molecular structure
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dimethylamine

ChemBase ID: 135259
Molecular Formular: C2H7N
Molecular Mass: 46.0770889
Monoisotopic Mass: 46.05488412
SMILES and InChIs

SMILES:
C[15NH]C
Canonical SMILES:
C[15NH]C
InChI:
InChI=1S/C2H7N/c1-3-2/h3H,1-2H3/i3+1
InChIKey:
ROSDSFDQCJNGOL-LBPDFUHNSA-N

Cite this record

CBID:135259 http://www.chembase.cn/molecule-135259.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
dimethylamine
IUPAC Traditional name
dimethylamine
Synonyms
Dimethylamine-15N
二甲胺-15N
MDL Number
MFCD00144138
PubChem SID
162229534
PubChem CID
12199011

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
Sigma Aldrich
608696 external link Add to cart Please log in.
Data Source Data ID
PubChem 12199011 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) -3.427765  LogD (pH = 7.4) -3.0703833 
Log P -0.19287847  Molar Refractivity 14.6934 cm3
Polarizability 5.9539757 Å3 Polar Surface Area 12.03 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Mass Shift
M+1 expand Show data source
European Hazard Symbols
Corrosive Corrosive (C) expand Show data source
Highly flammable Highly flammable (F+) expand Show data source
UN Number
1032 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
12-20/22-34 expand Show data source
Safety Statements
3-16-26-29-36/37/39-45 expand Show data source
GHS Pictograms
GHS02 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
H224-H302-H314-H332 expand Show data source
GHS Precautionary statements
P210-P280-P305 + P351 + P338-P310 expand Show data source
RID/ADR
UN 1032 2.1 expand Show data source
Isotopic Purity
98 atom % 15N expand Show data source
Linear Formula
(CH3)215NH expand Show data source

DETAILS

DETAILS

Sigma Aldrich Sigma Aldrich
Sigma Aldrich - 608696 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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