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1,8-Dimethylpyrene

HCID 186901
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Basic information

CAS
74869-47-9
Standard SMILES
Cc1ccc2ccc3ccc(C)c4ccc1c2c34
InChIKey
UBDSGGKJFIYCPC-UHFFFAOYSA-N
Molecular formula
C18H14
Average molar mass
230.3 g/mol
Monoisotopic mass
230.10955045

Names & identifiers

Preferred name
1,8-Dimethylpyrene
IUPAC
1,8-dimethylpyrene

Names & synonyms

1,8-dimethylpyrenePyrene, 1,8-dimethyl-74869-47-9RNC2GYV0BCUNII-RNC2GYV0BCDTXSID20225854Q27288206

Database identifiers

CAS
74869-47-9
PubChem CID
186901
DTXSID
DTXSID20225854
UNII
RNC2GYV0BC

Properties

Computed structural properties

XLogP
5.8
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
0
Heavy atoms
18
Formal charge
0
Complexity
288

Related reactions

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Compound notes

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