(8S)-8-(trifluoromethyl)tricyclo[5.3.0.02,5]decane

C11H15F3 — CID 163822352

IUPAC(8S)-8-(trifluoromethyl)tricyclo[5.3.0.02,5]decane
SMILESFC(F)(F)[C@H]1CCC2C3CCC3CC21
InChIInChI=1S/C11H15F3/c12-11(13,14)10-4-3-8-7-2-1-6(7)5-9(8)10/h6-10H,1-5H2/t6?,7?,8?,9?,10-/m0/s1
InChIKeyNWMIBJPVLODEBB-XZXVQBCNSA-N
MW204.23 g/mol
LogP3.62
Rot. Bonds

About (8S)-8-(trifluoromethyl)tricyclo[5.3.0.02,5]decane

(8S)-8-(trifluoromethyl)tricyclo[5.3.0.02,5]decane (PubChem CID 163822352) has the molecular formula C11H15F3 and a molecular weight of 204.23 g/mol. Its IUPAC name is (8S)-8-(trifluoromethyl)tricyclo[5.3.0.02,5]decane.

Molecular Properties

Compound Name(8S)-8-(trifluoromethyl)tricyclo[5.3.0.02,5]decane
PubChem CID163822352
Molecular FormulaC11H15F3
Molecular Weight204.23 g/mol
Exact Mass204.11
IUPAC Name(8S)-8-(trifluoromethyl)tricyclo[5.3.0.02,5]decane
SMILESFC(F)(F)[C@H]1CCC2C3CCC3CC21
InChIInChI=1S/C11H15F3/c12-11(13,14)10-4-3-8-7-2-1-6(7)5-9(8)10/h6-10H,1-5H2/t6?,7?,8?,9?,10-/m0/s1
InChIKeyNWMIBJPVLODEBB-XZXVQBCNSA-N
XLogP3.62
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.23
LogP ≤ 53.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of (8S)-8-(trifluoromethyl)tricyclo[5.3.0.02,5]decane?
The IUPAC name of (8S)-8-(trifluoromethyl)tricyclo[5.3.0.02,5]decane (CID 163822352) is (8S)-8-(trifluoromethyl)tricyclo[5.3.0.02,5]decane.
What is the SMILES notation for (8S)-8-(trifluoromethyl)tricyclo[5.3.0.02,5]decane?
The canonical SMILES for (8S)-8-(trifluoromethyl)tricyclo[5.3.0.02,5]decane is FC(F)(F)[C@H]1CCC2C3CCC3CC21.
What is the InChIKey of (8S)-8-(trifluoromethyl)tricyclo[5.3.0.02,5]decane?
The InChIKey is NWMIBJPVLODEBB-XZXVQBCNSA-N. The full InChI is InChI=1S/C11H15F3/c12-11(13,14)10-4-3-8-7-2-1-6(7)5-9(8)10/h6-10H,1-5H2/t6?,7?,8?,9?,10-/m0/s1.
What are the key properties of (8S)-8-(trifluoromethyl)tricyclo[5.3.0.02,5]decane?
(8S)-8-(trifluoromethyl)tricyclo[5.3.0.02,5]decane has a molecular weight of 204.23 g/mol, XLogP of 3.62, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (8S)-8-(trifluoromethyl)tricyclo[5.3.0.02,5]decane is sourced from PubChem (CID 163822352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).