2-naphthalen-2-yloxyethanol

C12H12O2 — CID 7131

IUPAC2-naphthalen-2-yloxyethanol
SMILESOCCOc1ccc2ccccc2c1
InChIInChI=1S/C12H12O2/c13-7-8-14-12-6-5-10-3-1-2-4-11(10)9-12/h1-6,9,13H,7-8H2
InChIKeyBQPBZDSDFCDSAO-UHFFFAOYSA-N
MW188.23 g/mol
LogP2.21
Rot. Bonds3

About 2-naphthalen-2-yloxyethanol

2-naphthalen-2-yloxyethanol (PubChem CID 7131) has the molecular formula C12H12O2 and a molecular weight of 188.23 g/mol. Its IUPAC name is 2-naphthalen-2-yloxyethanol.

Molecular Properties

Compound Name2-naphthalen-2-yloxyethanol
PubChem CID7131
Molecular FormulaC12H12O2
Molecular Weight188.23 g/mol
Exact Mass188.08
IUPAC Name2-naphthalen-2-yloxyethanol
SMILESOCCOc1ccc2ccccc2c1
InChIInChI=1S/C12H12O2/c13-7-8-14-12-6-5-10-3-1-2-4-11(10)9-12/h1-6,9,13H,7-8H2
InChIKeyBQPBZDSDFCDSAO-UHFFFAOYSA-N
XLogP2.21
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-naphthalen-2-yloxyethanol?
The IUPAC name of 2-naphthalen-2-yloxyethanol (CID 7131) is 2-naphthalen-2-yloxyethanol.
What is the SMILES notation for 2-naphthalen-2-yloxyethanol?
The canonical SMILES for 2-naphthalen-2-yloxyethanol is OCCOc1ccc2ccccc2c1.
What is the InChIKey of 2-naphthalen-2-yloxyethanol?
The InChIKey is BQPBZDSDFCDSAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12O2/c13-7-8-14-12-6-5-10-3-1-2-4-11(10)9-12/h1-6,9,13H,7-8H2.
What are the key properties of 2-naphthalen-2-yloxyethanol?
2-naphthalen-2-yloxyethanol has a molecular weight of 188.23 g/mol, XLogP of 2.21, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-naphthalen-2-yloxyethanol is sourced from PubChem (CID 7131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).