3-(1,1-Dimethylpropyl)-6,6-dimethylfulvene

HCID 17818147
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Basic information

Standard SMILES
CCC(C)(C)C1=CC(=C(C)C)C=C1
InChIKey
YFRXSDCXIOYFLO-UHFFFAOYSA-N
Molecular formula
C13H20
Average molar mass
176.3 g/mol
Monoisotopic mass
176.15650064

Names & identifiers

Preferred name
3-(1,1-Dimethylpropyl)-6,6-dimethylfulvene
IUPAC
2-(2-methylbutan-2-yl)-5-propan-2-ylidenecyclopenta-1,3-diene

Names & synonyms

SCHEMBL5009412YFRXSDCXIOYFLO-UHFFFAOYSA-N3-(1,1-dimethylpropyl)-6,6-dimethylfulvene

Database identifiers

PubChem CID
17818147

Properties

Computed structural properties

XLogP
4.6
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
2
Heavy atoms
13

Related reactions

6 records
New reaction record

Compound notes

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