(1S,2S,6R,7R)-tricyclo[5.2.1.02,6]dec-8-ene

C10H14 — CID 11094666

IUPAC(1S,2S,6R,7R)-tricyclo[5.2.1.02,6]dec-8-ene
SMILESC1=C[C@H]2C[C@@H]1[C@@H]1CCC[C@@H]12
InChIInChI=1S/C10H14/c1-2-9-7-4-5-8(6-7)10(9)3-1/h4-5,7-10H,1-3,6H2/t7-,8+,9+,10-
InChIKeyWHNYVDJJCTVMGO-FIRGSJFUSA-N
MW134.22 g/mol
LogP2.61
Rot. Bonds

About (1S,2S,6R,7R)-tricyclo[5.2.1.02,6]dec-8-ene

(1S,2S,6R,7R)-tricyclo[5.2.1.02,6]dec-8-ene (PubChem CID 11094666) has the molecular formula C10H14 and a molecular weight of 134.22 g/mol. Its IUPAC name is (1S,2S,6R,7R)-tricyclo[5.2.1.02,6]dec-8-ene.

Molecular Properties

Compound Name(1S,2S,6R,7R)-tricyclo[5.2.1.02,6]dec-8-ene
PubChem CID11094666
Molecular FormulaC10H14
Molecular Weight134.22 g/mol
Exact Mass134.11
IUPAC Name(1S,2S,6R,7R)-tricyclo[5.2.1.02,6]dec-8-ene
SMILESC1=C[C@H]2C[C@@H]1[C@@H]1CCC[C@@H]12
InChIInChI=1S/C10H14/c1-2-9-7-4-5-8(6-7)10(9)3-1/h4-5,7-10H,1-3,6H2/t7-,8+,9+,10-
InChIKeyWHNYVDJJCTVMGO-FIRGSJFUSA-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 ≤ 500134.22
LogP ≤ 52.61
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

Dicyclopentadiene
CID 6492
5-Vinyl-2-norbornene
CID 18273
Methylcyclopentadiene dimer
CID 3033878
Dihydrodicyclopentadiene
CID 95605
2,5-Dimethyldicyclopentadiene
CID 3437714
Tetracyclododecene
CID 136844
4,7-Methanoindene, 3a,4,7,7a-tetrahydro-, endo-(+)-
CID 10176158
4,7-Methano-1H-indene, 3a,4,7,7a-tetrahydro-, (3aalpha,4alpha,7alpha,7aalpha)-
CID 11815882
Bicyclo[2.2.1]hept-2-ene, 5-octyl-
CID 15701270
Silphinene
CID 44567200
1,2,3,3a,4,6a-Hexahydropentalene
CID 79127
5-(3-Cyclohexen-1-yl)bicyclo(2.2.1)hept-2-ene
CID 20835

Frequently Asked Questions

What is the IUPAC name of (1S,2S,6R,7R)-tricyclo[5.2.1.02,6]dec-8-ene?
The IUPAC name of (1S,2S,6R,7R)-tricyclo[5.2.1.02,6]dec-8-ene (CID 11094666) is (1S,2S,6R,7R)-tricyclo[5.2.1.02,6]dec-8-ene.
What is the SMILES notation for (1S,2S,6R,7R)-tricyclo[5.2.1.02,6]dec-8-ene?
The canonical SMILES for (1S,2S,6R,7R)-tricyclo[5.2.1.02,6]dec-8-ene is C1=C[C@H]2C[C@@H]1[C@@H]1CCC[C@@H]12.
What is the InChIKey of (1S,2S,6R,7R)-tricyclo[5.2.1.02,6]dec-8-ene?
The InChIKey is WHNYVDJJCTVMGO-FIRGSJFUSA-N. The full InChI is InChI=1S/C10H14/c1-2-9-7-4-5-8(6-7)10(9)3-1/h4-5,7-10H,1-3,6H2/t7-,8+,9+,10-.
What are the key properties of (1S,2S,6R,7R)-tricyclo[5.2.1.02,6]dec-8-ene?
(1S,2S,6R,7R)-tricyclo[5.2.1.02,6]dec-8-ene has a molecular weight of 134.22 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 (1S,2S,6R,7R)-tricyclo[5.2.1.02,6]dec-8-ene is sourced from PubChem (CID 11094666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).