1-(8-methylnaphthalen-1-yl)ethanol

C13H14O — CID 15563489

IUPAC1-(8-methylnaphthalen-1-yl)ethanol
SMILESCc1cccc2cccc(C(C)O)c12
InChIInChI=1S/C13H14O/c1-9-5-3-6-11-7-4-8-12(10(2)14)13(9)11/h3-8,10,14H,1-2H3
InChIKeyMKLDRFKUCXGLNE-UHFFFAOYSA-N
MW186.25 g/mol
LogP3.20
Rot. Bonds1

About 1-(8-methylnaphthalen-1-yl)ethanol

1-(8-methylnaphthalen-1-yl)ethanol (PubChem CID 15563489) has the molecular formula C13H14O and a molecular weight of 186.25 g/mol. Its IUPAC name is 1-(8-methylnaphthalen-1-yl)ethanol.

Molecular Properties

Compound Name1-(8-methylnaphthalen-1-yl)ethanol
PubChem CID15563489
Molecular FormulaC13H14O
Molecular Weight186.25 g/mol
Exact Mass186.10
IUPAC Name1-(8-methylnaphthalen-1-yl)ethanol
SMILESCc1cccc2cccc(C(C)O)c12
InChIInChI=1S/C13H14O/c1-9-5-3-6-11-7-4-8-12(10(2)14)13(9)11/h3-8,10,14H,1-2H3
InChIKeyMKLDRFKUCXGLNE-UHFFFAOYSA-N
XLogP3.20
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 53.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(8-methylnaphthalen-1-yl)ethanol?
The IUPAC name of 1-(8-methylnaphthalen-1-yl)ethanol (CID 15563489) is 1-(8-methylnaphthalen-1-yl)ethanol.
What is the SMILES notation for 1-(8-methylnaphthalen-1-yl)ethanol?
The canonical SMILES for 1-(8-methylnaphthalen-1-yl)ethanol is Cc1cccc2cccc(C(C)O)c12.
What is the InChIKey of 1-(8-methylnaphthalen-1-yl)ethanol?
The InChIKey is MKLDRFKUCXGLNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14O/c1-9-5-3-6-11-7-4-8-12(10(2)14)13(9)11/h3-8,10,14H,1-2H3.
What are the key properties of 1-(8-methylnaphthalen-1-yl)ethanol?
1-(8-methylnaphthalen-1-yl)ethanol has a molecular weight of 186.25 g/mol, XLogP of 3.20, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(8-methylnaphthalen-1-yl)ethanol is sourced from PubChem (CID 15563489), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).