tetracyclo[4.4.0.02,4.07,9]dec-4-ene

C10H12 — CID 163437767

IUPACtetracyclo[4.4.0.02,4.07,9]dec-4-ene
SMILESC1=C2CC2C2CC3CC3C12
InChIInChI=1S/C10H12/c1-5-3-10-8-2-6(8)4-9(10)7(1)5/h3,6-10H,1-2,4H2
InChIKeyAVYKWHKATIXXER-UHFFFAOYSA-N
MW132.21 g/mol
LogP2.22
Rot. Bonds

About tetracyclo[4.4.0.02,4.07,9]dec-4-ene

tetracyclo[4.4.0.02,4.07,9]dec-4-ene (PubChem CID 163437767) has the molecular formula C10H12 and a molecular weight of 132.21 g/mol. Its IUPAC name is tetracyclo[4.4.0.02,4.07,9]dec-4-ene.

Molecular Properties

Compound Nametetracyclo[4.4.0.02,4.07,9]dec-4-ene
PubChem CID163437767
Molecular FormulaC10H12
Molecular Weight132.21 g/mol
Exact Mass132.09
IUPAC Nametetracyclo[4.4.0.02,4.07,9]dec-4-ene
SMILESC1=C2CC2C2CC3CC3C12
InChIInChI=1S/C10H12/c1-5-3-10-8-2-6(8)4-9(10)7(1)5/h3,6-10H,1-2,4H2
InChIKeyAVYKWHKATIXXER-UHFFFAOYSA-N
XLogP2.22
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.21
LogP ≤ 52.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(5aS)-1,1a,1b,2,3,4,5,5a-octahydrocyclopropa[a]indene
CID 18640213
2-(cyclopenten-1-yl)bicyclo[2.1.0]pentane
CID 147366284
pentacyclo[6.6.1.02,7.010,15.011,13]pentadeca-2,4,6,13-tetraene
CID 54058975
tricyclo[2.2.1.02,6]hept-3-ene
CID 12705526
(7R)-7-methyltricyclo[3.2.1.03,8]oct-2-ene
CID 163938709
(1S,3R,5S,6R)-tricyclo[3.2.1.03,6]octane-2-carboxylic acid
CID 131034566
tricyclo[4.3.0.02,4]non-8-ene
CID 154517803
11-methylpentacyclo[6.5.0.02,7.03,13.05,9]tridec-12-ene
CID 123553439
tetracyclo[5.4.0.02,10.03,5]undec-7-ene
CID 147386331
(1R,2R,3S,4S,5S)-5-hydroxybicyclo[2.2.1]heptane-2,3-dicarboxylic acid
CID 98523903
(1R,2R,3S,4R,5R)-5-hydroxybicyclo[2.2.1]heptane-2,3-dicarboxylic acid
CID 130754555
(1S,3R,6R)-tricyclo[2.2.1.02,6]heptane-3-carboxylic acid
CID 55300462

Frequently Asked Questions

What is the IUPAC name of tetracyclo[4.4.0.02,4.07,9]dec-4-ene?
The IUPAC name of tetracyclo[4.4.0.02,4.07,9]dec-4-ene (CID 163437767) is tetracyclo[4.4.0.02,4.07,9]dec-4-ene.
What is the SMILES notation for tetracyclo[4.4.0.02,4.07,9]dec-4-ene?
The canonical SMILES for tetracyclo[4.4.0.02,4.07,9]dec-4-ene is C1=C2CC2C2CC3CC3C12.
What is the InChIKey of tetracyclo[4.4.0.02,4.07,9]dec-4-ene?
The InChIKey is AVYKWHKATIXXER-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12/c1-5-3-10-8-2-6(8)4-9(10)7(1)5/h3,6-10H,1-2,4H2.
What are the key properties of tetracyclo[4.4.0.02,4.07,9]dec-4-ene?
tetracyclo[4.4.0.02,4.07,9]dec-4-ene has a molecular weight of 132.21 g/mol, XLogP of 2.22, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tetracyclo[4.4.0.02,4.07,9]dec-4-ene is sourced from PubChem (CID 163437767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).