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Home> Hot Product Listed B   > Butyl 2-propenoate polymer with 1-(3,4-dichlorophenyl)-1H-pyrrole-2,5-dione, ethenylbenzene, 2,5-fur...
191-07-1 structure

Butyl 2-propenoate polymer with 1-(3,4-dichlorophenyl)-1H-pyrrole-2,5-dione, ethenylbenzene, 2,5-furandione and 2-methyl-2-[(1-oxo-2-propenyl)amino]-1-propanesulfonic acid

Iupac Name:coronene
CAS No.:191-07-1
Molecular Weight:300.35208
Molecular Formula: (isomer)
Names and Identifiers
Synonyms

Inchi
InChI=1/C24H12/c1-2-14-5-6-16-9-11-18-12-10-17-8-7-15-4-3-13(1)19-20(14)22(16)24(18)23(17)21(15)19/h1-12H
InChkey
VPUGDVKSAQVFFS-UHFFFAOYSA-N
Canonical Smiles
C1=CC2=C3C4=C1C=CC5=C4C6=C(C=C5)C=CC7=C6C3=C(C=C2)C=C7
Properties
Melting Point
438-440℃
Vapour
1.3E-10mmHg at 25°C
Refractive Index
2.139
Safety and Handling
Risk Statements
R20/21/22
Safety Statements
S36/37
HazardClass
6.1(b)
PackingGroup
III
Transport
2811
Reach Info
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Specific target organ toxicity \u2013 single exposure, Category 2

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word

Warning

Hazard statement(s)

H371 May cause damage to organs

Precautionary statement(s)
Prevention

P260 Do not breathe dust/fume/gas/mist/vapours/spray.

P264 Wash ... thoroughly after handling.

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

Response

P308+P311 IF exposed or concerned: Call a POISON CENTER/doctor/...

Storage

P405 Store locked up.

Disposal

P501 Dispose of contents/container to ...

2.3 Other hazards which do not result in classification

none

Computational chemical data
  • Molecular Weight:300.35208g/mol
  • Molecular Formula:
  • XLogP3-AA:7.2
  • Exact Mass:300.0939
  • Monoisotopic Mass:300.0939
  • Complexity:376
  • Rotatable Bond Count:0
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:0
  • Topological Polar Surface Area:0
  • Heavy Atom Count:24
  • 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
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