2-[8-(2-hydroxyphenyl)-8-tricyclo[5.2.1.02,6]decanyl]phenol

C22H24O2 — CID 19877938

IUPAC2-[8-(2-hydroxyphenyl)-8-tricyclo[5.2.1.02,6]decanyl]phenol
SMILESOc1ccccc1C1(c2ccccc2O)CC2CC1C1CCCC21
InChIInChI=1S/C22H24O2/c23-20-10-3-1-8-17(20)22(18-9-2-4-11-21(18)24)13-14-12-19(22)16-7-5-6-15(14)16/h1-4,8-11,14-16,19,23-24H,5-7,12-13H2
InChIKeyKQNYDOHUGUTKDX-UHFFFAOYSA-N
MW320.43 g/mol
LogP4.84
Rot. Bonds2

About 2-[8-(2-hydroxyphenyl)-8-tricyclo[5.2.1.02,6]decanyl]phenol

2-[8-(2-hydroxyphenyl)-8-tricyclo[5.2.1.02,6]decanyl]phenol (PubChem CID 19877938) has the molecular formula C22H24O2 and a molecular weight of 320.43 g/mol. Its IUPAC name is 2-[8-(2-hydroxyphenyl)-8-tricyclo[5.2.1.02,6]decanyl]phenol.

Molecular Properties

Compound Name2-[8-(2-hydroxyphenyl)-8-tricyclo[5.2.1.02,6]decanyl]phenol
PubChem CID19877938
Molecular FormulaC22H24O2
Molecular Weight320.43 g/mol
Exact Mass320.18
IUPAC Name2-[8-(2-hydroxyphenyl)-8-tricyclo[5.2.1.02,6]decanyl]phenol
SMILESOc1ccccc1C1(c2ccccc2O)CC2CC1C1CCCC21
InChIInChI=1S/C22H24O2/c23-20-10-3-1-8-17(20)22(18-9-2-4-11-21(18)24)13-14-12-19(22)16-7-5-6-15(14)16/h1-4,8-11,14-16,19,23-24H,5-7,12-13H2
InChIKeyKQNYDOHUGUTKDX-UHFFFAOYSA-N
XLogP4.84
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.43
LogP ≤ 54.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[8-(2-hydroxyphenyl)-8-tricyclo[5.2.1.02,6]decanyl]phenol?
The IUPAC name of 2-[8-(2-hydroxyphenyl)-8-tricyclo[5.2.1.02,6]decanyl]phenol (CID 19877938) is 2-[8-(2-hydroxyphenyl)-8-tricyclo[5.2.1.02,6]decanyl]phenol.
What is the SMILES notation for 2-[8-(2-hydroxyphenyl)-8-tricyclo[5.2.1.02,6]decanyl]phenol?
The canonical SMILES for 2-[8-(2-hydroxyphenyl)-8-tricyclo[5.2.1.02,6]decanyl]phenol is Oc1ccccc1C1(c2ccccc2O)CC2CC1C1CCCC21.
What is the InChIKey of 2-[8-(2-hydroxyphenyl)-8-tricyclo[5.2.1.02,6]decanyl]phenol?
The InChIKey is KQNYDOHUGUTKDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24O2/c23-20-10-3-1-8-17(20)22(18-9-2-4-11-21(18)24)13-14-12-19(22)16-7-5-6-15(14)16/h1-4,8-11,14-16,19,23-24H,5-7,12-13H2.
What are the key properties of 2-[8-(2-hydroxyphenyl)-8-tricyclo[5.2.1.02,6]decanyl]phenol?
2-[8-(2-hydroxyphenyl)-8-tricyclo[5.2.1.02,6]decanyl]phenol has a molecular weight of 320.43 g/mol, XLogP of 4.84, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[8-(2-hydroxyphenyl)-8-tricyclo[5.2.1.02,6]decanyl]phenol is sourced from PubChem (CID 19877938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).