1,2,4a,8a-tetrahydronaphthalen-1-ol

C10H12O — CID 12755566

IUPAC1,2,4a,8a-tetrahydronaphthalen-1-ol
SMILESOC1CC=CC2C=CC=CC21
InChIInChI=1S/C10H12O/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-6,8-11H,7H2
InChIKeyVZQJSGMIJDUDPT-UHFFFAOYSA-N
MW148.20 g/mol
LogP1.67
Rot. Bonds

About 1,2,4a,8a-tetrahydronaphthalen-1-ol

1,2,4a,8a-tetrahydronaphthalen-1-ol (PubChem CID 12755566) has the molecular formula C10H12O and a molecular weight of 148.20 g/mol. Its IUPAC name is 1,2,4a,8a-tetrahydronaphthalen-1-ol.

Molecular Properties

Compound Name1,2,4a,8a-tetrahydronaphthalen-1-ol
PubChem CID12755566
Molecular FormulaC10H12O
Molecular Weight148.20 g/mol
Exact Mass148.09
IUPAC Name1,2,4a,8a-tetrahydronaphthalen-1-ol
SMILESOC1CC=CC2C=CC=CC21
InChIInChI=1S/C10H12O/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-6,8-11H,7H2
InChIKeyVZQJSGMIJDUDPT-UHFFFAOYSA-N
XLogP1.67
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.20
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

Di-hydrophenylethanol
CID 67967867
6-Propan-2-ylcyclohexa-2,4-dien-1-ol
CID 130420858
(1R,2S)-2-prop-2-enylcyclohex-3-en-1-ol
CID 11094697
(4aR,8aS)-4-methyl-1,2,4a,7,8,8a-hexahydronaphthalen-1-ol
CID 12882531
(1S,2R)-2-prop-2-enylcyclohex-3-en-1-ol
CID 13780507
1,5,8,8a-Tetrahydronaphthalen-1-ol
CID 91466165
(4S,6E)-2-methylnona-6,8-dien-4-ol
CID 162418483
6-Isopropenyl-5-methylene-3-cyclohexen-1-ol
CID 556436
1,3-Nonadien-6-ol, 8-methyl-
CID 5365762
1-Cyclohexa-2,4-dien-1-ylpropan-2-ol
CID 12614930
2,6-Dimethylcyclohex-3-en-1-ol
CID 15633889
4a,5,8,8a-Tetrahydronaphthalen-1-ol
CID 19105445

Frequently Asked Questions

What is the IUPAC name of 1,2,4a,8a-tetrahydronaphthalen-1-ol?
The IUPAC name of 1,2,4a,8a-tetrahydronaphthalen-1-ol (CID 12755566) is 1,2,4a,8a-tetrahydronaphthalen-1-ol.
What is the SMILES notation for 1,2,4a,8a-tetrahydronaphthalen-1-ol?
The canonical SMILES for 1,2,4a,8a-tetrahydronaphthalen-1-ol is OC1CC=CC2C=CC=CC21.
What is the InChIKey of 1,2,4a,8a-tetrahydronaphthalen-1-ol?
The InChIKey is VZQJSGMIJDUDPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12O/c11-10-7-3-5-8-4-1-2-6-9(8)10/h1-6,8-11H,7H2.
What are the key properties of 1,2,4a,8a-tetrahydronaphthalen-1-ol?
1,2,4a,8a-tetrahydronaphthalen-1-ol has a molecular weight of 148.20 g/mol, XLogP of 1.67, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,4a,8a-tetrahydronaphthalen-1-ol is sourced from PubChem (CID 12755566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).