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Home> Hot Product Listed 1   > 11W-0810
77-48-5 structure

11W-0810

CAS No.:77-48-5
Molecular Weight:285.92134
Molecular Formula:C27H28N2OS (isomer)
Names and Identifiers
Synonyms

6,8-dibromo-2-(4-fluorophenyl)quinoline AC1LS486 AKOS005079456 KS-000030DS MCULE-8591977035 MOLPORT-002-855-821 ZINC1395325

Inchi
InChI=1/C5H6Br2N2O2/c1-5(2)3(10)8(6)4(11)9(5)7/h1-2H3
Canonical Smiles
CC1(C(=O)N(C(=O)N1Br)Br)C
Properties
Melting Point
197-199℃
Refractive Index
1.621
HS Code
29332100
Safety and Handling
Risk Statements
R22;R34;R50;R8
Safety Statements
S17;S26;S36/37/39;S45;S61
HazardClass
5.1
PackingGroup
II
Transport
UN 3087 5.1/PG 2
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  
INTERMEDIATE JOINT INTERMEDIATE_USE_ONLY view >
Registered companies:
Registrant / Supplier details Latest dossier received
ICL Europe Coöperatief U.A. (OR3) 2013
more >
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Oxidizing solids, Category 3

Acute toxicity - Oral, Category 4

Skin irritation, Category 2

Eye irritation, Category 2A

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

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word

Warning

Hazard statement(s)

H272 May intensify fire; oxidizer

H302 Harmful if swallowed

H315 Causes skin irritation

H319 Causes serious eye irritation

H400 Very toxic to aquatic life

Precautionary statement(s)
Prevention

P210 Keep away from heat, hot surfaces, sparks, open flames and other ignition sources. No smoking.

P220 Keep away from clothing and other combustible materials.

P280 Wear protective gloves/protective clothing/eye protection/face protection.

P264 Wash ... thoroughly after handling.

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

P273 Avoid release to the environment.

Response

P370+P378 In case of fire: Use ... to extinguish.

P301+P312 IF SWALLOWED: Call a POISON CENTER/doctor/\u2026if you feel unwell.

P330 Rinse mouth.

P302+P352 IF ON SKIN: Wash with plenty of water/...

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

P332+P313 If skin irritation occurs: Get medical advice/attention.

P362+P364 Take off contaminated clothing and wash it before reuse.

P305+P351+P338 IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.

P337+P313 If eye irritation persists: Get medical advice/attention.

P391 Collect spillage.

Storage

none

Disposal

P501 Dispose of contents/container to ...

2.3 Other hazards which do not result in classification

none

Computational chemical data
  • Molecular Weight:285.92134g/mol
  • Molecular Formula:C27H28N2OS
  • Exact Mass:285.877556
  • Monoisotopic Mass:283.879603
  • Complexity:229
  • Rotatable Bond Count:0
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:2
  • Topological Polar Surface Area:40.6
  • Heavy Atom Count:11
  • 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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