(1R,3R,6R)-tricyclo[2.2.1.02,6]heptan-3-ol

C7H10O — CID 6979104

IUPAC(1R,3R,6R)-tricyclo[2.2.1.02,6]heptan-3-ol
SMILESO[C@@H]1C2C[C@H]3C1[C@@H]3C2
InChIInChI=1S/C7H10O/c8-7-3-1-4-5(2-3)6(4)7/h3-8H,1-2H2/t3?,4-,5-,6?,7-/m1/s1
InChIKeyOZMQKGXJENMAHL-LFLSBTFLSA-N
MW110.16 g/mol
LogP0.63
Rot. Bonds

About (1R,3R,6R)-tricyclo[2.2.1.02,6]heptan-3-ol

(1R,3R,6R)-tricyclo[2.2.1.02,6]heptan-3-ol (PubChem CID 6979104) has the molecular formula C7H10O and a molecular weight of 110.16 g/mol. Its IUPAC name is (1R,3R,6R)-tricyclo[2.2.1.02,6]heptan-3-ol.

Molecular Properties

Compound Name(1R,3R,6R)-tricyclo[2.2.1.02,6]heptan-3-ol
PubChem CID6979104
Molecular FormulaC7H10O
Molecular Weight110.16 g/mol
Exact Mass110.07
IUPAC Name(1R,3R,6R)-tricyclo[2.2.1.02,6]heptan-3-ol
SMILESO[C@@H]1C2C[C@H]3C1[C@@H]3C2
InChIInChI=1S/C7H10O/c8-7-3-1-4-5(2-3)6(4)7/h3-8H,1-2H2/t3?,4-,5-,6?,7-/m1/s1
InChIKeyOZMQKGXJENMAHL-LFLSBTFLSA-N
XLogP0.63
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500110.16
LogP ≤ 50.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-Norbornanol
CID 79028
Norborneol, exo-(+)-
CID 10855417
Nortricyclanol
CID 260917
Exo-Norborneol
CID 11040657
endo-Norborneol
CID 10975445
Bicyclo(2.2.1)heptan-2-ol, exo-
CID 12313474
endo-Bicyclo[2.2.1]heptan-2-ol
CID 10855416
Tricyclo[2.2.1.02,6]heptane-3,5-diol
CID 228894
Isonorborneol
CID 12313475
(1S,2S,3R,4R,5R,6R)-5-fluorotricyclo[2.2.1.02,6]heptan-3-ol
CID 10986241
(1S,2S,3R,4R,5S,6R)-5-fluorotricyclo[2.2.1.02,6]heptan-3-ol
CID 11073440
(1S,3R,4R,5S)-5-fluorotricyclo[2.2.1.02,6]heptan-3-ol
CID 23237257

Frequently Asked Questions

What is the IUPAC name of (1R,3R,6R)-tricyclo[2.2.1.02,6]heptan-3-ol?
The IUPAC name of (1R,3R,6R)-tricyclo[2.2.1.02,6]heptan-3-ol (CID 6979104) is (1R,3R,6R)-tricyclo[2.2.1.02,6]heptan-3-ol.
What is the SMILES notation for (1R,3R,6R)-tricyclo[2.2.1.02,6]heptan-3-ol?
The canonical SMILES for (1R,3R,6R)-tricyclo[2.2.1.02,6]heptan-3-ol is O[C@@H]1C2C[C@H]3C1[C@@H]3C2.
What is the InChIKey of (1R,3R,6R)-tricyclo[2.2.1.02,6]heptan-3-ol?
The InChIKey is OZMQKGXJENMAHL-LFLSBTFLSA-N. The full InChI is InChI=1S/C7H10O/c8-7-3-1-4-5(2-3)6(4)7/h3-8H,1-2H2/t3?,4-,5-,6?,7-/m1/s1.
What are the key properties of (1R,3R,6R)-tricyclo[2.2.1.02,6]heptan-3-ol?
(1R,3R,6R)-tricyclo[2.2.1.02,6]heptan-3-ol has a molecular weight of 110.16 g/mol, XLogP of 0.63, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,3R,6R)-tricyclo[2.2.1.02,6]heptan-3-ol is sourced from PubChem (CID 6979104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).