2-[methoxy(phenyl)methyl]naphthalene

C18H16O — CID 91386153

IUPAC2-[methoxy(phenyl)methyl]naphthalene
SMILESCOC(c1ccccc1)c1ccc2ccccc2c1
InChIInChI=1S/C18H16O/c1-19-18(15-8-3-2-4-9-15)17-12-11-14-7-5-6-10-16(14)13-17/h2-13,18H,1H3
InChIKeyTYIOWNODKUFYTJ-UHFFFAOYSA-N
MW248.33 g/mol
LogP4.58
Rot. Bonds3

About 2-[methoxy(phenyl)methyl]naphthalene

2-[methoxy(phenyl)methyl]naphthalene (PubChem CID 91386153) has the molecular formula C18H16O and a molecular weight of 248.33 g/mol. Its IUPAC name is 2-[methoxy(phenyl)methyl]naphthalene.

Molecular Properties

Compound Name2-[methoxy(phenyl)methyl]naphthalene
PubChem CID91386153
Molecular FormulaC18H16O
Molecular Weight248.33 g/mol
Exact Mass248.12
IUPAC Name2-[methoxy(phenyl)methyl]naphthalene
SMILESCOC(c1ccccc1)c1ccc2ccccc2c1
InChIInChI=1S/C18H16O/c1-19-18(15-8-3-2-4-9-15)17-12-11-14-7-5-6-10-16(14)13-17/h2-13,18H,1H3
InChIKeyTYIOWNODKUFYTJ-UHFFFAOYSA-N
XLogP4.58
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 54.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Benzo(a)pyrene 4,5-epoxide
CID 37786
9-Anthracenemethanol
CID 73848
1-Pyrenemethanol
CID 104977
12-Methylbenz(a)anthracene-7-methanol
CID 11285
6b,7a-Dihydrobenzo(10,11)chryseno(1,2-b)oxirene
CID 37455
7-Hydroxy-7,8,9,10-tetrahydrobenzo(a)pyrene
CID 97714
1-(1-Pyrenyl)ethanol
CID 119118
2-Pyrenemethanol
CID 146932
Methyl trityl ether
CID 136388
2-(Naphthalen-2-yl)oxirane
CID 30333
Ethyl trityl ether
CID 294563
7-Methylbenz(a)anthracene-12-methanol
CID 11284

Frequently Asked Questions

What is the IUPAC name of 2-[methoxy(phenyl)methyl]naphthalene?
The IUPAC name of 2-[methoxy(phenyl)methyl]naphthalene (CID 91386153) is 2-[methoxy(phenyl)methyl]naphthalene.
What is the SMILES notation for 2-[methoxy(phenyl)methyl]naphthalene?
The canonical SMILES for 2-[methoxy(phenyl)methyl]naphthalene is COC(c1ccccc1)c1ccc2ccccc2c1.
What is the InChIKey of 2-[methoxy(phenyl)methyl]naphthalene?
The InChIKey is TYIOWNODKUFYTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16O/c1-19-18(15-8-3-2-4-9-15)17-12-11-14-7-5-6-10-16(14)13-17/h2-13,18H,1H3.
What are the key properties of 2-[methoxy(phenyl)methyl]naphthalene?
2-[methoxy(phenyl)methyl]naphthalene has a molecular weight of 248.33 g/mol, XLogP of 4.58, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[methoxy(phenyl)methyl]naphthalene is sourced from PubChem (CID 91386153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).