1,5,6,7,8,8a-hexahydronaphthalen-2-ol

C10H14O — CID 68897886

IUPAC1,5,6,7,8,8a-hexahydronaphthalen-2-ol
SMILESOC1=CC=C2CCCCC2C1
InChIInChI=1S/C10H14O/c11-10-6-5-8-3-1-2-4-9(8)7-10/h5-6,9,11H,1-4,7H2
InChIKeyCYOIENDJTIPIRO-UHFFFAOYSA-N
MW150.22 g/mol
LogP2.95
Rot. Bonds

About 1,5,6,7,8,8a-hexahydronaphthalen-2-ol

1,5,6,7,8,8a-hexahydronaphthalen-2-ol (PubChem CID 68897886) has the molecular formula C10H14O and a molecular weight of 150.22 g/mol. Its IUPAC name is 1,5,6,7,8,8a-hexahydronaphthalen-2-ol.

Molecular Properties

Compound Name1,5,6,7,8,8a-hexahydronaphthalen-2-ol
PubChem CID68897886
Molecular FormulaC10H14O
Molecular Weight150.22 g/mol
Exact Mass150.10
IUPAC Name1,5,6,7,8,8a-hexahydronaphthalen-2-ol
SMILESOC1=CC=C2CCCCC2C1
InChIInChI=1S/C10H14O/c11-10-6-5-8-3-1-2-4-9(8)7-10/h5-6,9,11H,1-4,7H2
InChIKeyCYOIENDJTIPIRO-UHFFFAOYSA-N
XLogP2.95
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1,5,6,7,8,8a-hexahydronaphthalen-2-ol?
The IUPAC name of 1,5,6,7,8,8a-hexahydronaphthalen-2-ol (CID 68897886) is 1,5,6,7,8,8a-hexahydronaphthalen-2-ol.
What is the SMILES notation for 1,5,6,7,8,8a-hexahydronaphthalen-2-ol?
The canonical SMILES for 1,5,6,7,8,8a-hexahydronaphthalen-2-ol is OC1=CC=C2CCCCC2C1.
What is the InChIKey of 1,5,6,7,8,8a-hexahydronaphthalen-2-ol?
The InChIKey is CYOIENDJTIPIRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14O/c11-10-6-5-8-3-1-2-4-9(8)7-10/h5-6,9,11H,1-4,7H2.
What are the key properties of 1,5,6,7,8,8a-hexahydronaphthalen-2-ol?
1,5,6,7,8,8a-hexahydronaphthalen-2-ol has a molecular weight of 150.22 g/mol, XLogP of 2.95, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,5,6,7,8,8a-hexahydronaphthalen-2-ol is sourced from PubChem (CID 68897886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).