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2,3,6,7,10,11-Hexabromotriphenylene

Catalog Number
ACM82632802-3
CAS Number
82632-80-2
Product Name
2,3,6,7,10,11-Hexabromotriphenylene
Structure
Category
Liquid Crystal (LC) Building Blocks; Small Molecule Semiconductor Building Blocks
Synonyms
Triphenylene, 2,3,6,7,10,11-hexabromo-
IUPAC Name
2,3,6,7,10,11-hexabromotriphenylene
Molecular Weight
701.66
Molecular Formula
C18H6Br6
Canonical SMILES
C1=C2C3=CC(=C(C=C3C4=CC(=C(C=C4C2=CC(=C1Br)Br)Br)Br)Br)Br
InChI
InChI=1S/C18H6Br6/c19-13-1-7-8(2-14(13)20)10-4-17(23)18(24)6-12(10)11-5-16(22)15(21)3-9(7)11/h1-6H
InChI Key
GLHQUXLCQLQNPZ-UHFFFAOYSA-N
Boiling Point
689.8 ± 50.0 °C(predicted)
Purity
98%
Density
2.428 ± 0.06 g/mL (predicted)
Appearance
Grey solid powder
Complexity
364
Covalently-Bonded Unit Count
1
Exact Mass
701.55083g/mol
Formal Charge
0
Hazard Statements
H315 : Causes skin irritation.H319 : Causes serious eye irritation.
Heavy Atom Count
24
Monoisotopic Mass
695.55698g/mol
Precautionary Statements
P264 : Wash skin thoroughly after handling.P280 : Wear protective gloves/ eye protection/ face protection.P337 + P313 : If eye irritation persists: Get medical advice/ attention.P305 + P351 + P338 : IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continue rinsing.P302 + P352 : IF ON SKIN: Wash with plenty of soap and water.P332 + P313 : If skin irritation occurs: Get medical advice/ attention.P362 : Take off contaminated clothing and wash before reuse.
Rotatable Bond Count
0
Signal Word
Warning
XLogP3
9
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