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140-56-7 molecular structure
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sodium (E)-N-{[4-(dimethylamino)phenyl]imino}sulfamate

ChemBase ID: 130542
Molecular Formular: C8H10N3NaO3S
Molecular Mass: 251.23807
Monoisotopic Mass: 251.03405648
SMILES and InChIs

SMILES:
CN(C)c1ccc(cc1)/N=N/S(=O)(=O)[O-].[Na+]
Canonical SMILES:
CN(c1ccc(cc1)/N=N/S(=O)(=O)[O-])C.[Na+]
InChI:
InChI=1S/C8H11N3O3S.Na/c1-11(2)8-5-3-7(4-6-8)9-10-15(12,13)14;/h3-6H,1-2H3,(H,12,13,14);/q;+1/p-1/b10-9+;
InChIKey:
IWDQPCIQCXRBQP-RRABGKBLSA-M

Cite this record

CBID:130542 http://www.chembase.cn/molecule-130542.html

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NAMES AND DATABASE IDS

NAMES AND DATABASE IDS

Names Database IDs
IUPAC name
sodium (E)-N-{[4-(dimethylamino)phenyl]imino}sulfamate
sodium N-{[4-(dimethylamino)phenyl]imino}sulfamate
IUPAC Traditional name
sodium (E)-N-{[4-(dimethylamino)phenyl]imino}sulfamate
sodium N-{[4-(dimethylamino)phenyl]imino}sulfamate
Synonyms
p-Diazodimethylaniline sodium sulfonate
Sodium [4-(dimethylamino)phenyl]diazenesulfonate
Fenaminosulf
250MG - Dexon
Fenaminosulf
Dexon
4-Dimethylaminobenzenediazosulfonic acid sodium salt
对二甲氨基苯重氮磺酸 钠盐
敌克松
敌克松
CAS Number
140-56-7
EC Number
205-419-4
MDL Number
MFCD00059900
Beilstein Number
4170376
PubChem SID
24868976
24893570
24899174
162224820
PubChem CID
23668198

DATA SOURCES

DATA SOURCES

All Sources Commercial Sources Non-commercial Sources
Data Source Data ID
PubChem 23668198 external link

CALCULATED PROPERTIES

CALCULATED PROPERTIES

JChem
Acid pKa -2.0387619  H Acceptors
H Donor LogD (pH = 5.5) -0.9763149 
LogD (pH = 7.4) -1.0532887  Log P 0.2760169 
Molar Refractivity 57.2016 cm3 Polarizability 21.424171 Å3
Polar Surface Area 85.16 Å2 Rotatable Bonds
Lipinski's Rule of Five true 

PROPERTIES

PROPERTIES

Safety Information Product Information Bioassay(PubChem)
RTECS
CZ1750000 expand Show data source
European Hazard Symbols
Toxic Toxic (T) expand Show data source
UN Number
2811 expand Show data source
MSDS Link
Download expand Show data source
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
21-25-52/53 expand Show data source
Safety Statements
36/37-45-61 expand Show data source
GHS Pictograms
GHS06 expand Show data source
GHS Signal Word
Danger expand Show data source
GHS Hazard statements
H301-H312-H412 expand Show data source
GHS Precautionary statements
P273-P280-P301 + P310 expand Show data source
Personal Protective Equipment
Eyeshields, Faceshields, Gloves, type P2 (EN 143) respirator cartridges expand Show data source
RID/ADR
UN 2811 6.1/PG 3 expand Show data source
Storage Temperature
-20°C expand Show data source
Purity
≥98% expand Show data source
Grade
analytical standard expand Show data source
PESTANAL®, analytical standard expand Show data source
Packaging
ampule of 1000 mg expand Show data source
Linear Formula
C8H10N3O3SNa expand Show data source

DETAILS

DETAILS

Sigma Aldrich Sigma Aldrich
Sigma Aldrich - D1928 external link
包装
1 g in glass bottle
Application
Used in biological and pharmacological studies including:
• Cloning and characterization of GABA transporter1
• Activity of anti-RSV carbonucleosides2
• Inhibition by fungicides of urea hydrolysis and nitrification of urea nitrogen in soil3
Sigma Aldrich - 45482 external link
Application
Used in biological and pharmacological studies including:
• Cloning and characterization of GABA transporter1
• Activity of anti-RSV carbonucleosides2
• Inhibition by fungicides of urea hydrolysis and nitrification of urea nitrogen in soil3
Legal Information
PESTANAL is a registered trademark of Sigma-Aldrich Laborchemikalien GmbH
Sigma Aldrich - PS262 external link
Application
Used in biological and pharmacological studies including:
• Cloning and characterization of GABA transporter1
• Activity of anti-RSV carbonucleosides2
• Inhibition by fungicides of urea hydrolysis and nitrification of urea nitrogen in soil3

REFERENCES

REFERENCES

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PATENTS

PATENTS

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INTERNET

INTERNET

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