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Home> Hot Product Listed S   > styrene-4-sulfonic acid
105763-77-7 structure

styrene-4-sulfonic acid

Iupac Name:2,4-dichloro-6-methoxyquinazoline
CAS No.:105763-77-7
EINECS(EC#): 200-882-9
Molecular Weight:229.06
Molecular Formula:C10H16O (isomer)
Names and Identifiers
Synonyms

4-styrene sulfonic acid 4-styrenesulfonic acid p-Styrenesulfonic acid styrene-4-sulphonic acid styrene-p-sulphonic acid styrenesulfonic acid

Inchi
InChI=1S/C9H6Cl2N2O/c1-14-5-2-3-7-6(4-5)8(10)13-9(11)12-7/h2-4H,1H3
InChkey
WEAMQTSRMCCGSJ-UHFFFAOYSA-N
Canonical Smiles
COC1=CC2=C(C=C1)N=C(N=C2Cl)Cl
Properties
Appearance
Colorless to Yellow Liquid
Density
1.28
Flash Point
272.5°C
Solubility
H2O: soluble
Other physical and chemical properties
Solid
Safety and Handling
Risk Statements
25
Safety Statements
45
HazardClass
IRRITANT
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

no data available

2.2 GHS label elements, including precautionary statements

Pictogram(s) no data available
Signal word

no data available

Hazard statement(s)

no data available

Precautionary statement(s)
Prevention

no data available

Response

no data available

Storage

no data available

Disposal

no data available

2.3 Other hazards which do not result in classification

no data available

Computational chemical data
  • Molecular Weight:229.06g/mol
  • Molecular Formula:C10H16O
  • Compound Is Canonicalized:True
  • Exact Mass:227.986
  • Monoisotopic Mass:227.986
  • Complexity:205
  • Rotatable Bond Count:1
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:3
  • Topological Polar Surface Area:35A^2
  • Heavy Atom Count:14
  • 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:1
  • CACTVS Substructure Key Fingerprint: AAADcYBzIAAGAAAAAAAAAAAAAAAAAAAAAAA8QAAAAAAAAACx8AAAHgIAAAAADA6BniIz1vYIFACg AyRiZACCiCkhJqAJmCA2bpiMLqLF+9uENChswBNI6CewwBAOAEABAAACAAAAgAIAAAQAAAAAAAAA AA==
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