Products
  • Products
  • Buy offers
  • Encyclopedia
  • Msds lib
  • Synthesis
  • Reach Info
  • Suppliers
Home> Hot Product Listed M   > MOLPORT-006-334-249
591-50-4 structure

MOLPORT-006-334-249

Iupac Name:iodobenzene
CAS No.:591-50-4
Molecular Weight:204.00800
Molecular Formula:C11H13N3O2S (isomer)
Names and Identifiers
Synonyms

2-(3-methyl-1h-1,2,4-triazol-5-yl)-8-(tetrahydrofuran-2-ylmethyl)pyrido[4,3-b][1,6]naphthyridine-1,9(2h,8h)-dione AKOS003174295 AKOS016279320 MCULE-8257370431 MOLPORT-015-161-328 STK978559 STOCK6S-96233

Inchi
InChI=1S/C6H5I/c7-6-4-2-1-3-5-6/h1-5H
InChkey
SNHMUERNLJLMHN-UHFFFAOYSA-N
Canonical Smiles
C1=CC=C(C=C1)I
Properties
Melting Point
−29°C(lit.)
Refractive Index
n20/D 1.62(lit.)
HS Code
2827600000
Safety and Handling
Risk Statements
R22; R36
Safety Statements
S26-S36
Transport
25kgs
Reach Info
Globally, no enterprise has officially registered the substance REACH.
Other official information: ·ECHA Information Page for CAS: 591-50-4 EC: MOLPORT-006-334-249 ·ECHA C&L Inventory for CAS: CAS: 591-50-4 EC: MOLPORT-006-334-249
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Acute toxicity - Oral, Category 4

Eye irritation, Category 2

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word

Warning

Hazard statement(s)

H302 Harmful if swallowed

H319 Causes serious eye irritation

Precautionary statement(s)
Prevention

P264 Wash ... thoroughly after handling.

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

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

Response

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

P330 Rinse mouth.

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.

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:204.00800g/mol
  • Molecular Formula:C11H13N3O2S
  • Compound Is Canonicalized:True
  • XLogP3-AA:3.2
  • Exact Mass:203.944
  • Monoisotopic Mass:203.944
  • Complexity:46.1
  • Rotatable Bond Count:0
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:0
  • Topological Polar Surface Area:0A^2
  • Heavy Atom Count:7
  • 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: AAADcYBgAAAAAgAAAAAAAAAAAAAAAAAAAAAwAAAAAAAAAAABAAAAGAAgAAAACACCEAAwAIAAAACA ACBCAAACAAAgAAAIiAAAAIgIICKAERCAIAAggAAIiAcAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA AA==
Recommended Suppliers
  • Tel:86-571-88938639
  • Fax:86-571-88938652
  • Tel:+86-0592-5567629
  • Fax:+86-0592-5567629
  • Tel:86-571-85829152
  • Fax:86-571-85829153
  • Tel:86-371-86658258
  • Fax:86-371-86658258
  • Tel:86-27-13407111142
  • Fax:86-27-13407111142
  • Tel:86-25-83697070
  • Fax:86-25-83453275
  • Tel:86-571-87396430
  • Fax:86-571-87396431
  • Tel:86-571-86960370
  • Fax:86-571-86940780
  • Tel:86-27-83214668
  • Fax:86-27-83214668
  • Tel:86-27-87465837
  • Fax:86-27-87772287
Recommended Suppliers
  • Tel:86-571-88938639
  • Fax:86-571-88938652
  • Tel:+86-0592-5567629
  • Fax:+86-0592-5567629
  • Tel:86-571-85829152
  • Fax:86-571-85829153
  • Tel:86-371-86658258
  • Fax:86-371-86658258
  • Tel:86-27-13407111142
  • Fax:86-27-13407111142
  • Tel:86-25-83697070
  • Fax:86-25-83453275
  • Tel:86-571-87396430
  • Fax:86-571-87396431
  • Tel:86-571-86960370
  • Fax:86-571-86940780
  • Tel:86-27-83214668
  • Fax:86-27-83214668
  • Tel:86-27-87465837
  • Fax:86-27-87772287
 
<