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Molecule
ID:126038
Structure
Similarity
Functional Group
Text
General Information
Structure
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Molecular Formula
C₁₀H₁₀
Molecular Mass
130.1864
Exact Mass
130.07825032
Charge
0
InChI
InChI=1S/C10H10/c1-2-4-7-5-3(1)6-8(4)10(7)9(5)6/h1-10H
InChIKey
LXQOIQYQFRKBLV-UHFFFAOYSA-N
Canonic Smiles
C1=CC2C3C4C1C1C2C3C41
Isomeric Smiles
C1=CC2C3C4C5C3C1C5C24
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
0.96846485
LogD (pH = 7.4)
0.96846485
Log P
0.96846485
Molar Refractivity
39.4986
Polarizability
15.271834
Polar Surface Area
0.0
Rotatable Bonds
0
Lipinski's Rule of Five
true
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Bioactivity
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Data Source
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Basketene
PubChem
138538
Names and Identifiers
IUPAC Traditional name
basketene
Synonyms
Bishomocubene
Basketene
IUPAC name
pentacyclo[4.4.0.0
2
,
5
.0
3
,
8
.0
4
,
7
]dec-9-ene
Registration numbers
Chemspider ID
122156
PubChem CID
138538
Wikipedia Title
Basketene
PubChem SID
162220379
Properties
Safety Information
Safety Statements
R
Source
Molecule Details
Wikipedia
Basketene
References
PubChem Literature
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Bioactivity
PubChem BioAssay