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Home> Hot Product Listed S   > STOCK5S-43231
2530-85-0 structure

STOCK5S-43231

CAS No.:2530-85-0
Molecular Weight:248.3483
Molecular Formula:C18H26CLNO (isomer)
Names and Identifiers
Synonyms

3-[(4-bromobenzyl)sulfanyl]-5-(3-chlorophenyl)-4-phenyl-4h-1,2,4-triazole 3-[(4-bromophenyl)methylsulfanyl]-5-(3-chlorophenyl)-4-phenyl-1,2,4-triazole 3-[(4-bromophenyl)methylthio]-5-(3-chlorophenyl)-4-phenyl-1,2,4-triazole 3-{[(4-bromophenyl)methyl]sulfanyl}-5-(3-chlorophenyl)-4-phenyl-4h-1,2,4-triazole AC1LY6X1 AC1Q3K2D AKOS005502621 MOLPORT-001-853-721 STK578527 ZINC2235974

Inchi
InChI=1/C10H20O5Si/c1-9(2)10(11)15-7-6-8-16(12-3,13-4)14-5/h1,6-8H2,2-5H3
InChkey
XDLMVUHYZWKMMD-UHFFFAOYSA-N
Canonical Smiles
CC(=C)C(=O)OCCC[Si](OC)(OC)OC
Properties
Melting Point
<-50 °C
Vapour
0.089mmHg at 25°C
Refractive Index
1.43-1.432
Safety and Handling
Risk Statements
R36/37/38
Safety Statements
S26;S37/39
Transport
3082
Reach Info
This substance has been officially registered by enterprises.
ECHA (EU chemicals Management Agency) published the completed registration file as follows:
Completed registration file:
Registered as ubmitted Total tonnage band  
FULL JOINT 1000_10000 view >
Registered companies:
Registrant / Supplier details Latest dossier received
3M Belgium BVBA/SPRL 2016
Cabot Performance Materials Belgium SPRL 2016
Dow Corning Europe S.A. - OR - DCC 2015
more >
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

Computational chemical data
  • Molecular Weight:248.3483g/mol
  • Molecular Formula:C18H26CLNO
  • Exact Mass:248.108
  • Monoisotopic Mass:248.108
  • Complexity:229
  • Rotatable Bond Count:9
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:5
  • Topological Polar Surface Area:54
  • Heavy Atom Count:16
  • 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
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