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312623-95-3 molecular structure
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(2H4)hydrazine; bis(chloro(2H))

ChemBase ID: 138022
Molecular Formular: Cl2H6N2
Molecular Mass: 104.96704
Monoisotopic Mass: 103.99080356
SMILES and InChIs

SMILES:
NN.Cl.Cl
Canonical SMILES:
NN.Cl.Cl
InChI:
InChI=1S/2ClH.H4N2/c;;1-2/h2*1H;1-2H2
InChIKey:
LIAWOTKNAVAKCX-UHFFFAOYSA-N

Cite this record

CBID:138022 http://www.chembase.cn/molecule-138022.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
(2H4)hydrazine; bis(chloro(2H))
IUPAC Traditional name
(2H4)hydrazine; bis(chloro(2H))
Synonyms
Hydrazine-d4 dideuteriochloride
肼-d4 二氘代盐酸盐
CAS Number
312623-95-3
MDL Number
MFCD01075467
PubChem SID
24872779
162232281
PubChem CID
71310097

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID Price
Sigma Aldrich
492795 external link Add to cart Please log in.
Data Source Data ID
PubChem 71310097 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
H Acceptors H Donor
LogD (pH = 5.5) -1.2863406  LogD (pH = 7.4) -1.0380839 
Log P -1.0337903  Molar Refractivity 10.5682 cm3
Polarizability 3.5840569 Å3 Polar Surface Area 52.04 Å2
Rotatable Bonds Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Physical Property Safety Information Product Information Bioassay(PubChem)
Melting Point
200 °C (dec.)(lit.) expand Show data source
Mass Shift
M+6 expand Show data source
European Hazard Symbols
Nature polluting Nature polluting (N) expand Show data source
Toxic Toxic (T) expand Show data source
UN Number
2811 expand Show data source
MSDS Link
Download expand Show data source
German water hazard class
3 expand Show data source
Hazard Class
6.1 expand Show data source
Packing Group
3 expand Show data source
Risk Statements
45-10-23/24/25-34-43-50/53 expand Show data source
Safety Statements
53-45-60-61 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
H226-H301-H311-H314-H317-H331-H350-H410 expand Show data source
GHS Precautionary statements
P201-P261-P273-P280-P301 + P310-P305 + P351 + P338 expand Show data source
RID/ADR
UN 2811 6.1/PG 3 expand Show data source
Isotopic Purity
98 atom % D expand Show data source
Mol. Weight
mol wt 110.94 by atom % calculation expand Show data source
Linear Formula
D2NND2 · 2DCl expand Show data source

DETAILS

DETAILS

Sigma Aldrich Sigma Aldrich
Sigma Aldrich - 492795 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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