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Home> Hot Product Listed A   > AKOS006281166
6284-40-8 structure

AKOS006281166

CAS No.:6284-40-8
Molecular Weight:195.21358
Molecular Formula:C19H19CLN2O2 (isomer)
Names and Identifiers
Synonyms

3-ethoxy-2,4-difluorobenzenecarbonitrile 3-ethoxy-2,4-difluorobenzonitrile 3-ethoxy-2,4-difluorobenzonitrile, jrd AK190981 BG01506543 CTK6G0209 fch834968 mfcd09258732 pc303063 SBB090000 ZINC38529956

Inchi
InChI=1/C7H17NO5/c1-8-2-4(10)6(12)7(13)5(11)3-9/h4-13H,2-3H2,1H3/t4-,5+,6+,7+/m0/s1
Canonical Smiles
CNCC(C(C(C(CO)O)O)O)O
Isomers Smiles
CNC[C@@H]([C@H]([C@@H]([C@@H](CO)O)O)O)O
Properties
Melting Point
128-132℃
Refractive Index
-16.5 ° (C=2, H2O)
Alpha
-16.5 º (C=10, H2O, ON DRY SUB)
HS Code
29221980
Safety and Handling
Risk Statements
R36/37/38
Safety Statements
S24/25
Transport
25kgs
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  
FULL JOINT 10_100 view >
INTERMEDIATE JOINT INTERMEDIATE_USE_ONLY view >
Registered companies:
Registrant / Supplier details Latest dossier received
Clariant Produkte (Deutschland) GmbH 2016
Henkel Global Supply Chain B.V. 2017
Global Amines Germany GmbH 2015
more >
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Serious eye damage, Category 1

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word

Danger

Hazard statement(s)

H318 Causes serious eye damage

Precautionary statement(s)
Prevention

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

Response

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

P310 Immediately call a POISON CENTER/doctor/\u2026

Storage

none

Disposal

none

2.3 Other hazards which do not result in classification

none

Computational chemical data
  • Molecular Weight:195.21358g/mol
  • Molecular Formula:C19H19CLN2O2
  • XLogP3-AA:_2.8
  • Exact Mass:195.110673
  • Monoisotopic Mass:195.110673
  • Complexity:134
  • Rotatable Bond Count:6
  • Hydrogen Bond Donor Count:6
  • Hydrogen Bond Acceptor Count:6
  • Topological Polar Surface Area:113
  • Heavy Atom Count:13
  • Defined Atom Stereocenter Count:4
  • 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:0086-27-59207850
  • Fax:0086-27-59524646
  • Tel:86-311-66561638
  • Fax:86-311-66561638
  • Tel:86-571-88938639
  • Fax:86-571-88938652
  • Tel:86-571-85829152
  • Fax:86-571-85829153
  • Tel:+86-0592-5567629
  • Fax:+86-0592-5567629
  • Tel:86-27-111111
  • Fax:86-27-111111
  • Tel:86-25-83697070
  • Fax:86-25-83453275
  • Tel:86-571-87396430
  • Fax:86-571-87396431
  • Tel:86-755-33239182
  • Fax:86-755-33233381
  • Tel:86-571-86960370
  • Fax:86-571-86940780
 
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