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4,5,9,10-Tetrahydropyrene (purified by sublimation)

Catalog Number
ACM781179-1
CAS Number
781-17-9
Product Name
4,5,9,10-Tetrahydropyrene (purified by sublimation)
Structure
Category
Other Material Building Blocks; Small Molecule Semiconductor Building Blocks
IUPAC Name
4,5,9,10-tetrahydropyrene
Molecular Weight
206.28g/mol
Molecular Formula
C16H14
Canonical SMILES
C1CC2=C3C(=CC=C2)CCC4=CC=CC1=C43
InChI
InChI=1S/C16H14/c1-3-11-7-9-13-5-2-6-14-10-8-12(4-1)15(11)16(13)14/h1-6H,7-10H2
InChI Key
XDFUNRTWHPWCKO-UHFFFAOYSA-N
Complexity
217
Covalently-Bonded Unit Count
1
Exact Mass
206.10955g/mol
Formal Charge
0
Heavy Atom Count
16
Monoisotopic Mass
206.10955g/mol
Rotatable Bond Count
0
XLogP3
4.1
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