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Home> Encyclopedia > Hot Product Listed 2   > 2,7-Naphthalenedisulfonic acid, 4-amino-5-hydroxy-, diazotized, coupled with 4-nitrobenzenamine and ...
7624-31-9 structure

2,7-Naphthalenedisulfonic acid, 4-amino-5-hydroxy-, diazotized, coupled with 4-nitrobenzenamine and resorcinol

Iupac Name:1-propyl-2H-tetrazole-5-thione
CAS No.:7624-31-9
Molecular Weight:144.196
Molecular Formula:C9H9N (isomer)
Names and Identifiers
Synonyms

Inchi
InChI=1S/C4H8N4S/c1-2-3-8-4(9)5-6-7-8/h2-3H2,1H3,(H,5,7,9)
InChkey
BVVDPRQMYYDZHL-UHFFFAOYSA-N
Canonical Smiles
CCCN1C(=S)N=NN1
Properties
Density
1.147
Boiling Point
352.4℃ at760mmHg
Refractive Index
1.693
Flash Point
95.9°C
HS Code
2933990090
Computational chemical data
  • Molecular Weight:144.196g/mol
  • Molecular Formula:C9H9N
  • Compound Is Canonicalized:True
  • Exact Mass:144.047
  • Monoisotopic Mass:144.047
  • Complexity:144
  • Rotatable Bond Count:2
  • Hydrogen Bond Donor Count:1
  • Hydrogen Bond Acceptor Count:3
  • Topological Polar Surface Area:72.1A^2
  • Heavy Atom Count:9
  • 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: AAADccBjgABAAAAAAAAAAAAAAAAAAQAAAAAAAAAAAAAAAAAAAAAAHAQYAAAACADBAAQDAAICAAAG AAAAAAAAAAAAAAgUIAAIAACAAAAAAAAEAAAAAAIAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA AA==
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