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6-(Methyl)-6-(n-butyl)fulvene

HCID 562143
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Basic information

CAS
61039-45-0
Standard SMILES
CCCCC(C)=C1C=CC=C1
InChIKey
CJVKBBJZQUKURJ-UHFFFAOYSA-N
Molecular formula
C11H16
Average molar mass
148.24 g/mol
Monoisotopic mass
148.12520051

Names & identifiers

Preferred name
6-(Methyl)-6-(n-butyl)fulvene
IUPAC
5-hexan-2-ylidenecyclopenta-1,3-diene

Names & synonyms

6-(Methyl)-6-(n-butyl)fulvene61039-45-0DTXSID60340156RefChem:306866DTXCID802912371,3-Cyclopentadiene, 5-(1-methylpentylidene)-5-(HEXAN-2-YLIDENE)CYCLOPENTA-1,3-DIENESCHEMBL56148835-(1-Methylpentylidene)-1,3-cyclopentadiene #

Database identifiers

CAS
61039-45-0
PubChem CID
562143
DTXSID
DTXSID60340156
Nikkaji
J840.836J

Properties

Computed structural properties

XLogP
4.3
Topological polar surface area
0 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
0
Rotatable bonds
3
Heavy atoms
11
Formal charge
0
Complexity
190

Related reactions

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Compound notes

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