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Home> Hot Product Listed F   > F3342-0219
56-84-8 structure

F3342-0219

CAS No.:56-84-8
Molecular Weight:133.10268
Molecular Formula:C14H11F4N5O (isomer)
Names and Identifiers
Synonyms

AKOS024482485 MCULE-5463481845 MOLPORT-009-701-406 n-(2-hydroxy-3-(m-tolyloxy)propyl)-n-mesitylmethanesulfonamide VU0611429-1

Inchi
InChI=1/C4H7NO4/c5-2(4(8)9)1-3(6)7/h2H,1,5H2,(H,6,7)(H,8,9)/t2-/m0/s1
Canonical Smiles
C(C(C(=O)O)N)C(=O)O
Isomers Smiles
C([C@@H](C(=O)O)N)C(=O)O
Properties
Melting Point
230℃
Alpha
25 o (C=8, 6N HCL)
HS Code
29224995
Safety and Handling
Risk Statements
R36
Safety Statements
S22;S24/25
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 INDIVIDUAL INTERMEDIATE_USE_ONLY view >
FULL JOINT 1000PLUS view >
Registered companies:
Registrant / Supplier details Latest dossier received
AJINOMOTO FOODS EUROPE S.A.S. 2013
ARCHROMA IBÉRICA, S.L. 2013
CHEMICAL INSPECTION & REGULATION SERVICE LIMITED 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:133.10268g/mol
  • Molecular Formula:C14H11F4N5O
  • XLogP3-AA:_2.8
  • Exact Mass:133.037508
  • Monoisotopic Mass:133.037508
  • Complexity:133
  • Rotatable Bond Count:3
  • Hydrogen Bond Donor Count:3
  • Hydrogen Bond Acceptor Count:5
  • Topological Polar Surface Area:101
  • Heavy Atom Count:9
  • Defined Atom Stereocenter Count:1
  • 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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Recommended Suppliers
  • Tel:86-21-15301650010
  • Fax:86-21-61263399
  • Tel:86-571-88938639
  • Fax:86-571-88938652
  • Tel:0086-27-59207850
  • Fax:0086-27-59524646
  • 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:86-27-111111
  • Fax:86-27-111111
  • Tel:86-25-83697070
  • Fax:86-25-83453275
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  • Tel:+86-025-58535435
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