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

C10H14 — CID 13425243

IUPAC(1S,7R)-tricyclo[5.2.1.02,6]dec-2(6)-ene
SMILESC1CC2=C(C1)[C@H]1CC[C@@H]2C1
InChIInChI=1S/C10H14/c1-2-9-7-4-5-8(6-7)10(9)3-1/h7-8H,1-6H2/t7-,8+
InChIKeyPQVUHZTZNWXIMW-OCAPTIKFSA-N
MW134.22 g/mol
LogP2.90
Rot. Bonds

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

(1S,7R)-tricyclo[5.2.1.02,6]dec-2(6)-ene (PubChem CID 13425243) has the molecular formula C10H14 and a molecular weight of 134.22 g/mol. Its IUPAC name is (1S,7R)-tricyclo[5.2.1.02,6]dec-2(6)-ene.

Molecular Properties

Compound Name(1S,7R)-tricyclo[5.2.1.02,6]dec-2(6)-ene
PubChem CID13425243
Molecular FormulaC10H14
Molecular Weight134.22 g/mol
Exact Mass134.11
IUPAC Name(1S,7R)-tricyclo[5.2.1.02,6]dec-2(6)-ene
SMILESC1CC2=C(C1)[C@H]1CC[C@@H]2C1
InChIInChI=1S/C10H14/c1-2-9-7-4-5-8(6-7)10(9)3-1/h7-8H,1-6H2/t7-,8+
InChIKeyPQVUHZTZNWXIMW-OCAPTIKFSA-N
XLogP2.90
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 ≤ 52.90
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

tricyclo[6.2.1.02,6]undec-2(6)-ene
CID 12898252
(1S,7R)-bicyclo[5.2.1]decane-2,6-dione
CID 10964881
bicyclo[5.2.1]decane-2,6-dione
CID 13115377
2-(2-bicyclo[3.3.1]nonanylidene)bicyclo[3.3.1]nonane
CID 54344742
4-tricyclo[6.2.1.02,7]undec-2(7)-enylmethanol
CID 130126509
4,5-dimethyltricyclo[6.2.1.02,7]undec-2(7)-ene
CID 141412995
(1S,3R,6S,8R)-tetracyclo[6.2.1.13,6.02,7]dodec-2(7)-ene
CID 12649555
acetaldehyde;acetic acid;ethanol;propan-2-one;bis(tricyclo[5.2.1.02,6]decane);tricyclo[5.2.1.02,6]dec-2(6)-ene
CID 160735355
tricyclo[6.2.2.02,7]dodec-2(7)-en-9-one
CID 71406170
tricyclo[6.2.1.02,7]undec-2(7)-ene-3,6-dione
CID 13070254
tricyclo[9.2.1.14,7]pentadecane-5,6,12,13-tetrone
CID 155116648
6,7,8,9-tetrachloro-1,2,3,4,4a,5,10,10a-octahydroanthracene
CID 163507629

Frequently Asked Questions

What is the IUPAC name of (1S,7R)-tricyclo[5.2.1.02,6]dec-2(6)-ene?
The IUPAC name of (1S,7R)-tricyclo[5.2.1.02,6]dec-2(6)-ene (CID 13425243) is (1S,7R)-tricyclo[5.2.1.02,6]dec-2(6)-ene.
What is the SMILES notation for (1S,7R)-tricyclo[5.2.1.02,6]dec-2(6)-ene?
The canonical SMILES for (1S,7R)-tricyclo[5.2.1.02,6]dec-2(6)-ene is C1CC2=C(C1)[C@H]1CC[C@@H]2C1.
What is the InChIKey of (1S,7R)-tricyclo[5.2.1.02,6]dec-2(6)-ene?
The InChIKey is PQVUHZTZNWXIMW-OCAPTIKFSA-N. The full InChI is InChI=1S/C10H14/c1-2-9-7-4-5-8(6-7)10(9)3-1/h7-8H,1-6H2/t7-,8+.
What are the key properties of (1S,7R)-tricyclo[5.2.1.02,6]dec-2(6)-ene?
(1S,7R)-tricyclo[5.2.1.02,6]dec-2(6)-ene has a molecular weight of 134.22 g/mol, XLogP of 2.90, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1S,7R)-tricyclo[5.2.1.02,6]dec-2(6)-ene is sourced from PubChem (CID 13425243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).