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Home> Hot Product Listed T   > T6623853
6294-34-4 structure

T6623853

Iupac Name:1-chloro-2-[2-chloroethoxy(2-chloroethyl)phosphoryl]oxyethane
CAS No.:6294-34-4
Molecular Weight:269.49000
Molecular Formula:C13H17BRN2OS (isomer)
Names and Identifiers
Synonyms

MCULE-4317695368 methyl 5-({1-[3-(2,3-dihydro-1-benzofuran-2-amido)phenyl]-n-methylformamido}methyl)-2-methylfuran-3-carboxylate MOLPORT-009-070-732 Z505476066

Inchi
InChI=1S/C6H12Cl3O3P/c7-1-4-11-13(10,6-3-9)12-5-2-8/h1-6H2
InChkey
XXIDKSWYSYEFAG-UHFFFAOYSA-N
Canonical Smiles
C(CCl)OP(=O)(CCCl)OCCCl
Safety and Handling
Safety Statements
Moderately toxic by ingestion. Low toxicity by skin contact. Experimental reproductive effects. A mild skin and eye irritant. When heated to decomposition it emits toxic vapors of POx and Cl−.
Reach Info
Globally, no enterprise has officially registered the substance REACH.
Other official information: ·ECHA Information Page for CAS: 6294-34-4 EC: T6623853 ·ECHA C&L Inventory for CAS: CAS: 6294-34-4 EC: T6623853
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Acute toxicity - Oral, Category 4

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word

Warning

Hazard statement(s)

H302 Harmful if swallowed

Precautionary statement(s)
Prevention

P264 Wash ... thoroughly after handling.

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

Response

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

P330 Rinse mouth.

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:269.49000g/mol
  • Molecular Formula:C13H17BRN2OS
  • Compound Is Canonicalized:True
  • Exact Mass:267.959
  • Monoisotopic Mass:267.959
  • Complexity:155
  • Rotatable Bond Count:8
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:3
  • Topological Polar Surface Area:35.5A^2
  • Heavy Atom Count:13
  • 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: AAADccBgMAIGAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAGgoAACAAAAOogEIAAAAAARAA QAAAAIAAAAAAAAAAAAAAAQAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAAA AA==
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