Products
  • Products
  • Buy offers
  • Encyclopedia
  • Msds lib
  • Synthesis
  • Reach Info
  • Suppliers
Home> Hot Product Listed 2   > 2H-1-Benzopyran-2-one, 3-[1-(4-chlorophenyl)-1H-imidazol-4-yl]-
6197-30-4 structure

2H-1-Benzopyran-2-one, 3-[1-(4-chlorophenyl)-1H-imidazol-4-yl]-

Iupac Name:2-ethylhexyl 2-cyano-3,3-diphenylprop-2-enoate
CAS No.:6197-30-4
Molecular Weight:361.48
Molecular Formula:C11H10CLNO3 (isomer)
Names and Identifiers
Synonyms

Inchi
InChI=1S/C24H27NO2/c1-3-5-12-19(4-2)18-27-24(26)22(17-25)23(20-13-8-6-9-14-20)21-15-10-7-11-16-21/h6-11,13-16,19H,3-5,12,18H2,1-2H3
InChkey
FMJSMJQBSVNSBF-UHFFFAOYSA-N
Canonical Smiles
CCCCC(CC)COC(=O)C(=C(C1=CC=CC=C1)C2=CC=CC=C2)C#N
Properties
Melting Point
−10 °C(lit.)
Refractive Index
n20/D 1.567(lit.)
HS Code
29269095
Safety and Handling
Risk Statements
52
Safety Statements
29/56
Transport
200gs
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 1000_10000 view >
Registered companies:
Registrant / Supplier details Latest dossier received
BASF SE 2010
DSM Nutritional Products GmbH- OR2 2011
DSM Nutritional Products Nederland B.V. 2016
more >
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Hazardous to the aquatic environment, long-term (Chronic) - Category Chronic 4

2.2 GHS label elements, including precautionary statements

Pictogram(s) No symbol.
Signal word

No signal word.

Hazard statement(s)

H413 May cause long lasting harmful effects to aquatic life

Precautionary statement(s)
Prevention

P273 Avoid release to the environment.

Response

none

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:361.48g/mol
  • Molecular Formula:C11H10CLNO3
  • Compound Is Canonicalized:True
  • Exact Mass:361.204
  • Monoisotopic Mass:361.204
  • Complexity:510
  • Rotatable Bond Count:10
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:3
  • Topological Polar Surface Area:50.1A^2
  • Heavy Atom Count:27
  • Defined Atom Stereocenter Count:0
  • Undefined Atom Stereocenter Count:1
  • Defined Bond Stereocenter Count:0
  • Undefined Bond Stereocenter Count:0
  • Isotope Atom Count:0
  • Covalently-Bonded Unit Count:1
  • CACTVS Substructure Key Fingerprint: AAADceB6MAAAAAAAAAAAAAAAAAAAAAAAAAAwYAAAAAAAAAABQAAAHgAAAAAADQChmAIyCIAABACY BiDSCAAiAAAgAAAIiAEAAMgIpCKAMRCCMAAkgAAIqQeAwMAOAAAAAAAAAAAAAAAAAAAAAAAAAAAA AA==
Recommended Suppliers
  • 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:86-571-86820258
  • Fax:86-571-86821328
  • Tel:86-21-54703619
  • Fax:86-21-54703699
  • Tel:86-188-74586545
  • Fax:86-27-83214668
  • Tel:86-27-87465837
  • Fax:86-27-87772287
  • Tel:0086-531-58773055
  • Fax:0086-531-58773066
Recommended Suppliers
  • 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:86-571-86820258
  • Fax:86-571-86821328
  • Tel:86-21-54703619
  • Fax:86-21-54703699
  • Tel:86-188-74586545
  • Fax:86-27-83214668
  • Tel:86-27-87465837
  • Fax:86-27-87772287
  • Tel:0086-531-58773055
  • Fax:0086-531-58773066
 
<