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Home> Hot Product Listed R   > Ruthenium, isotope ofmass 94
20283-92-5 structure

Ruthenium, isotope ofmass 94

Iupac Name:(2R)-3-(3,4-dihydroxyphenyl)-2-[(E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxypropanoic acid
CAS No.:20283-92-5
Molecular Weight:360.31
Molecular Formula:C59H47CL2N7O18 (isomer)
Names and Identifiers
Synonyms

94ru AC1L42TJ IN011916 Ru94 ruthenium, isotope of mass 94 ruthenium-94

Inchi
InChI=1S/C18H16O8/c19-12-4-1-10(7-14(12)21)3-6-17(23)26-16(18(24)25)9-11-2-5-13(20)15(22)8-11/h1-8,16,19-22H,9H2,(H,24,25)/b6-3+/t16-/m1/s1
InChkey
DOUMFZQKYFQNTF-WUTVXBCWSA-N
Canonical Smiles
C1=CC(=C(C=C1CC(C(=O)O)OC(=O)C=CC2=CC(=C(C=C2)O)O)O)O
Isomers Smiles
C1=CC(=C(C=C1CC(C(=O)O)OC(=O)/C=C/C2=CC(=C(C=C2)O)O)O)O
Properties
Melting Point
171-175 °C(lit.)
Vapour
2.92E-20mmHg at 25°C
Refractive Index
1.713
Flash Point
207.5°C
Safety and Handling
Risk Statements
25
Safety Statements
45
Reach Info
Globally, no enterprise has officially registered the substance REACH.
Other official information: ·ECHA Information Page for CAS: 20283-92-5 EC: Ruthenium, isotope ofmass 94 ·ECHA C&L Inventory for CAS: CAS: 20283-92-5 EC: Ruthenium, isotope ofmass 94
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Acute toxicity - Oral, Category 3

Hazardous to the aquatic environment, short-term (Acute) - Category Acute 1

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word

Danger

Hazard statement(s)

H301 Toxic if swallowed

H400 Very toxic to aquatic life

Precautionary statement(s)
Prevention

P264 Wash ... thoroughly after handling.

P270 Do not eat, drink or smoke when using this product.

P273 Avoid release to the environment.

Response

P301+P310 IF SWALLOWED: Immediately call a POISON CENTER/doctor/\u2026

P321 Specific treatment (see ... on this label).

P330 Rinse mouth.

P391 Collect spillage.

Storage

P405 Store locked up.

Disposal

P501 Dispose of contents/container to ...

2.3 Other hazards which do not result in classification

none

Computational chemical data
  • Molecular Weight:360.31g/mol
  • Molecular Formula:C59H47CL2N7O18
  • Compound Is Canonicalized:True
  • Exact Mass:360.085
  • Monoisotopic Mass:360.085
  • Complexity:519
  • Rotatable Bond Count:7
  • Hydrogen Bond Donor Count:5
  • Hydrogen Bond Acceptor Count:8
  • Topological Polar Surface Area:145A^2
  • Heavy Atom Count:26
  • Defined Atom Stereocenter Count:1
  • Undefined Atom Stereocenter Count:0
  • Defined Bond Stereocenter Count:1
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
  • CACTVS Substructure Key Fingerprint: AAADceB4PAAAAAAAAAAAAAAAAAAAAAAAAAAwYAAAAAAAAAABQAAAGgAACAAADBSgmAIwDoAABgCI AiDSCAICAAAgIAAIiAFGiMgJJjKCMRaCcAEkwBELuYeI6LyOIAABAAAAQABAAAIAAACAAAAAAAAA AA==
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