spiro[4.5]deca-1,3,7,9-tetraene

C10H10 — CID 59741992

IUPACspiro[4.5]deca-1,3,7,9-tetraene
SMILESC1=CCC2(C=C1)C=CC=C2
InChIInChI=1S/C10H10/c1-2-6-10(7-3-1)8-4-5-9-10/h1-6,8-9H,7H2
InChIKeyPFQKGSCSIQKRPQ-UHFFFAOYSA-N
MW130.19 g/mol
LogP2.61
Rot. Bonds

About spiro[4.5]deca-1,3,7,9-tetraene

spiro[4.5]deca-1,3,7,9-tetraene (PubChem CID 59741992) has the molecular formula C10H10 and a molecular weight of 130.19 g/mol. Its IUPAC name is spiro[4.5]deca-1,3,7,9-tetraene.

Molecular Properties

Compound Namespiro[4.5]deca-1,3,7,9-tetraene
PubChem CID59741992
Molecular FormulaC10H10
Molecular Weight130.19 g/mol
Exact Mass130.08
IUPAC Namespiro[4.5]deca-1,3,7,9-tetraene
SMILESC1=CCC2(C=C1)C=CC=C2
InChIInChI=1S/C10H10/c1-2-6-10(7-3-1)8-4-5-9-10/h1-6,8-9H,7H2
InChIKeyPFQKGSCSIQKRPQ-UHFFFAOYSA-N
XLogP2.61
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.19
LogP ≤ 52.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of spiro[4.5]deca-1,3,7,9-tetraene?
The IUPAC name of spiro[4.5]deca-1,3,7,9-tetraene (CID 59741992) is spiro[4.5]deca-1,3,7,9-tetraene.
What is the SMILES notation for spiro[4.5]deca-1,3,7,9-tetraene?
The canonical SMILES for spiro[4.5]deca-1,3,7,9-tetraene is C1=CCC2(C=C1)C=CC=C2.
What is the InChIKey of spiro[4.5]deca-1,3,7,9-tetraene?
The InChIKey is PFQKGSCSIQKRPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10/c1-2-6-10(7-3-1)8-4-5-9-10/h1-6,8-9H,7H2.
What are the key properties of spiro[4.5]deca-1,3,7,9-tetraene?
spiro[4.5]deca-1,3,7,9-tetraene has a molecular weight of 130.19 g/mol, XLogP of 2.61, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[4.5]deca-1,3,7,9-tetraene is sourced from PubChem (CID 59741992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).