1-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)ethanol

C14H20O — CID 66436316

IUPAC1-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)ethanol
SMILESCC(O)C1CCC(C)(C)c2ccccc21
InChIInChI=1S/C14H20O/c1-10(15)11-8-9-14(2,3)13-7-5-4-6-12(11)13/h4-7,10-11,15H,8-9H2,1-3H3
InChIKeyYSCVYPFUBVURIN-UHFFFAOYSA-N
MW204.31 g/mol
LogP3.22
Rot. Bonds1

About 1-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)ethanol

1-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)ethanol (PubChem CID 66436316) has the molecular formula C14H20O and a molecular weight of 204.31 g/mol. Its IUPAC name is 1-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)ethanol.

Molecular Properties

Compound Name1-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)ethanol
PubChem CID66436316
Molecular FormulaC14H20O
Molecular Weight204.31 g/mol
Exact Mass204.15
IUPAC Name1-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)ethanol
SMILESCC(O)C1CCC(C)(C)c2ccccc21
InChIInChI=1S/C14H20O/c1-10(15)11-8-9-14(2,3)13-7-5-4-6-12(11)13/h4-7,10-11,15H,8-9H2,1-3H3
InChIKeyYSCVYPFUBVURIN-UHFFFAOYSA-N
XLogP3.22
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.31
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)ethanol?
The IUPAC name of 1-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)ethanol (CID 66436316) is 1-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)ethanol.
What is the SMILES notation for 1-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)ethanol?
The canonical SMILES for 1-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)ethanol is CC(O)C1CCC(C)(C)c2ccccc21.
What is the InChIKey of 1-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)ethanol?
The InChIKey is YSCVYPFUBVURIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20O/c1-10(15)11-8-9-14(2,3)13-7-5-4-6-12(11)13/h4-7,10-11,15H,8-9H2,1-3H3.
What are the key properties of 1-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)ethanol?
1-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)ethanol has a molecular weight of 204.31 g/mol, XLogP of 3.22, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4,4-dimethyl-2,3-dihydro-1H-naphthalen-1-yl)ethanol is sourced from PubChem (CID 66436316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).