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Home> Encyclopedia >   /  Carbonate  /  Food Additives  /  Other Inorganic Chemicals  /  Pharmaceutical Intermediates  /  Alkali
Benzene, 1-[[isocyano(4-methoxyphenyl)methyl]sulfonyl]-4-methyl- structure
Benzene, 1-[[isocyano(4-methoxyphenyl)methyl]sulfonyl]-4-methyl- structure

Benzene, 1-[[isocyano(4-methoxyphenyl)methyl]sulfonyl]-4-methyl-

Iupac Name:sodium carbonate
CAS No.:144-55-8
Molecular Weight:84.00661
1. Names and Identifiers
1.1 Name
Benzene, 1-[[isocyano(4-methoxyphenyl)methyl]sulfonyl]-4-methyl-
1.2 Synonyms

(4-METHOXYPHENYL)[(4-METHYLPHENYL)SULFONYL]ACETONITRILE (4-Methoxyphenyl)[(4-methylphenyl)sulphonyl]acetonitrile [1-(4-METHOXYPHENYL)-1-TOSYL]METHYL ISOCYANIDE 1-[Isocyano(4-methoxyphenyl)methanesulfonyl]-4-methylbenzene ALPHA-TOSYL-(4-METHOXYBENZYL) ISOCYANIDE A-TOSYL-(4-METHOXYBENZYL) ISOCYANIDE ISOCYANO(4-METHOXYPHENYL)METHYL-4-METHYLPHENYL SULFONE Isocyano(4-methoxyphenyl)methyl-4-methylphenyl sulphone

1.3 CAS No.
144-55-8
1.4 CID
516892
1.5 Molecular Formula
C20H39N3NA2O6S (isomer)
1.6 Inchi
InChI=1S/CH2O3.Na/c2-1(3)4;/h(H2,2,3,4);/q;+1/p-1
1.7 InChkey
UIIMBOGNXHQVGW-UHFFFAOYSA-M
1.8 Canonical Smiles
C(=O)(O)[O-].[Na+]
1.9 Isomers Smiles
C(=O)(O)[O-].[Na+]
2. 3D Conformer
3. Properties
3.1 Density
1.347
3.2 Melting Point
270℃
3.3 Boiling Point
463.3°C at 760 mmHg
3.4 Vapour
2.58E-05mmHg at 25°C
3.5 Refractive Index
1.500
4. Safety and Handling
4.1 Safety Statements
S24/25
4.2 PackingGroup
Z01
4.3 Transport
无资料?
5. MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Not classified.

2.2 GHS label elements, including precautionary statements

Pictogram(s) No symbol.
Signal word

No signal word.

Hazard statement(s)

none

Precautionary statement(s)
Prevention

none

Response

none

Storage

none

Disposal

none

2.3 Other hazards which do not result in classification

none

6. Computational chemical data
  • Molecular Weight:84.00661g/mol
  • Molecular Formula:C20H39N3NA2O6S
  • Exact Mass:83.982339
  • Monoisotopic Mass:83.982339
  • Complexity:33.9
  • Rotatable Bond Count:0
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:3
  • Topological Polar Surface Area:60.4
  • Heavy Atom Count:5
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:2
8. Question & Answer
  • I wanted to know what reaction would occur between copper metal and sodium bicarbonate? I believe that once in sodium bicarbonate solution, the copper metal will go into solution as copper ions and replace the sodium ions. Is this wrong? Also, if it is indeed true, what would the reaction between c...
  • The 5.00 g is a mixture of sodium bicarbonate and an unknown substance, making it impure. Balanced decomposition equation: 2 N a H C O X 3 ( s ) ⟶ N a C O X 3 ( s ) + H X 2 O ( g ) + C O X 2 ( g ) " style="text-align: center; position: relative;" tabindex="0" id="MathJax-Element-2-Frame"...
  • The first step is usually called an acid-base reaction or a proton transfer. Any acid of similar strength to citric or acetic (vinegar) acids will react with bicarbonate this way, and it is very fast in water solution at room temperature. The products are carbonic acid and the sodium salt of the ac...
  • I am searching for a molecule that is edible for human, reacts to liquid by generating C O X 2 " style="position: relative;" tabindex="0" id="MathJax-Element-2-Frame" class="MathJax" C O X 2 C O X 2 or a similar gas and that leaves behind a clear liquid, similar to sodium bicarbonate but without th...
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