1-benzyl-2-ethoxynaphthalene

C19H18O — CID 12064074

IUPAC1-benzyl-2-ethoxynaphthalene
SMILESCCOc1ccc2ccccc2c1Cc1ccccc1
InChIInChI=1S/C19H18O/c1-2-20-19-13-12-16-10-6-7-11-17(16)18(19)14-15-8-4-3-5-9-15/h3-13H,2,14H2,1H3
InChIKeyOXOPBZZTBZVEJG-UHFFFAOYSA-N
MW262.35 g/mol
LogP4.83
Rot. Bonds4

About 1-benzyl-2-ethoxynaphthalene

1-benzyl-2-ethoxynaphthalene (PubChem CID 12064074) has the molecular formula C19H18O and a molecular weight of 262.35 g/mol. Its IUPAC name is 1-benzyl-2-ethoxynaphthalene.

Molecular Properties

Compound Name1-benzyl-2-ethoxynaphthalene
PubChem CID12064074
Molecular FormulaC19H18O
Molecular Weight262.35 g/mol
Exact Mass262.14
IUPAC Name1-benzyl-2-ethoxynaphthalene
SMILESCCOc1ccc2ccccc2c1Cc1ccccc1
InChIInChI=1S/C19H18O/c1-2-20-19-13-12-16-10-6-7-11-17(16)18(19)14-15-8-4-3-5-9-15/h3-13H,2,14H2,1H3
InChIKeyOXOPBZZTBZVEJG-UHFFFAOYSA-N
XLogP4.83
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 54.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Etofenprox
CID 71245
2-Methoxynaphthalene
CID 7119
Cra 13
CID 9799417
2-((1-Naphthalenyloxy)methyl)oxirane
CID 91521
2-Ethoxynaphthalene
CID 7129
1-Methoxynaphthalene
CID 16668
2-(2-Methylpropoxy)naphthalene
CID 16582
Ethyl 3-oxo-3H-naphtho(2,1-b)pyran-2-carboxylate
CID 69774
1,4-Dimethoxyanthracene
CID 83107
Benzyl 2-naphthyl ether
CID 123080
Butyl beta-naphthyl ether
CID 82664
Benzo(kl)xanthene
CID 67456

Frequently Asked Questions

What is the IUPAC name of 1-benzyl-2-ethoxynaphthalene?
The IUPAC name of 1-benzyl-2-ethoxynaphthalene (CID 12064074) is 1-benzyl-2-ethoxynaphthalene.
What is the SMILES notation for 1-benzyl-2-ethoxynaphthalene?
The canonical SMILES for 1-benzyl-2-ethoxynaphthalene is CCOc1ccc2ccccc2c1Cc1ccccc1.
What is the InChIKey of 1-benzyl-2-ethoxynaphthalene?
The InChIKey is OXOPBZZTBZVEJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18O/c1-2-20-19-13-12-16-10-6-7-11-17(16)18(19)14-15-8-4-3-5-9-15/h3-13H,2,14H2,1H3.
What are the key properties of 1-benzyl-2-ethoxynaphthalene?
1-benzyl-2-ethoxynaphthalene has a molecular weight of 262.35 g/mol, XLogP of 4.83, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-2-ethoxynaphthalene is sourced from PubChem (CID 12064074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).