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About This Item
Empirical Formula (Hill Notation):
C12H18
CAS Number:
Molecular Weight:
162.27
Beilstein:
969880
EC Number:
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
Quality Level
Assay
99%
form
solid
bp
237-238 °C (lit.)
mp
33-35 °C (lit.)
SMILES string
C1C\C=C\CC\C=C\CC\C=C\1
InChI
1S/C12H18/c1-2-4-6-8-10-12-11-9-7-5-3-1/h1-2,7-10H,3-6,11-12H2/b2-1+,9-7+,10-8+
InChI key
ZOLLIQAKMYWTBR-FFWAUJBHSA-N
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General description
trans,trans,trans-1,5,9-Cyclododecatriene (ttt-cdt) acts as ligand and forms rare copper complexes. Photorearrangements of CuCl complexes of ttt-cdt has been investigated.
Application
trans,trans,trans-1,5,9-Cyclododecatriene has been used in the construction of building block for the synthesis of potent antitumor annonaceous acetogenin (+)-parviflorin.
Signal Word
Danger
Hazard Statements
Precautionary Statements
Hazard Classifications
Skin Corr. 1B
Storage Class Code
6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects
WGK
WGK 3
Flash Point(F)
163.4 °F - closed cup
Flash Point(C)
73 °C - closed cup
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
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