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Home> Hot Product Listed D   > Diazene, [4-(2-nitroethenyl)phenyl]phenyl-
67774-74-7 structure

Diazene, [4-(2-nitroethenyl)phenyl]phenyl-

CAS No.:67774-74-7
Molecular Weight:627.58416
Molecular Formula:C14H11BRO2S (isomer)
Names and Identifiers
Synonyms

Inchi
InChI=1S/C12H4Br6/c13-7-3-11(17)9(15)1-5(7)6-2-10(16)12(18)4-8(6)14/h1-4H
Canonical Smiles
C1=C(C(=CC(=C1Br)Br)Br)C2=CC(=C(C=C2Br)Br)Br
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 100000_1000000 view >
Registered companies:
Registrant / Supplier details Latest dossier received
BiPRO GmbH 2010
CEPSA Química, S.A. 2015
CEPSA Química, S.A. Becancour OR 2010
more >
MSDS

2.Hazard identification

2.1 Classification of the substance or mixture

Aspiration hazard, Category 1

2.2 GHS label elements, including precautionary statements

Pictogram(s)
Signal word

Danger

Hazard statement(s)

H304 May be fatal if swallowed and enters airways

Precautionary statement(s)
Prevention

none

Response

P301+P310 IF SWALLOWED: Immediately call a POISON CENTER/doctor/…

P331 Do NOT induce vomiting.

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:627.58416g/mol
  • Molecular Formula:C14H11BRO2S
  • XLogP3-AA:7.8
  • Exact Mass:627.535186
  • Monoisotopic Mass:621.541326
  • Complexity:258
  • Rotatable Bond Count:1
  • Hydrogen Bond Donor Count:0
  • Hydrogen Bond Acceptor Count:0
  • Topological Polar Surface Area:0
  • Heavy Atom Count:18
  • 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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