2-methoxynaphthalene;2-phenylnaphthalene

C27H22O — CID 173269029

IUPAC2-methoxynaphthalene;2-phenylnaphthalene
SMILESCOc1ccc2ccccc2c1.c1ccc(-c2ccc3ccccc3c2)cc1
InChIInChI=1S/C16H12.C11H10O/c1-2-6-13(7-3-1)16-11-10-14-8-4-5-9-15(14)12-16;1-12-11-7-6-9-4-2-3-5-10(9)8-11/h1-12H;2-8H,1H3
InChIKeyCHNKYTCWAIYJQY-UHFFFAOYSA-N
MW362.47 g/mol
LogP7.36
Rot. Bonds2

About 2-methoxynaphthalene;2-phenylnaphthalene

2-methoxynaphthalene;2-phenylnaphthalene (PubChem CID 173269029) has the molecular formula C27H22O and a molecular weight of 362.47 g/mol. Its IUPAC name is 2-methoxynaphthalene;2-phenylnaphthalene.

Molecular Properties

Compound Name2-methoxynaphthalene;2-phenylnaphthalene
PubChem CID173269029
Molecular FormulaC27H22O
Molecular Weight362.47 g/mol
Exact Mass362.17
IUPAC Name2-methoxynaphthalene;2-phenylnaphthalene
SMILESCOc1ccc2ccccc2c1.c1ccc(-c2ccc3ccccc3c2)cc1
InChIInChI=1S/C16H12.C11H10O/c1-2-6-13(7-3-1)16-11-10-14-8-4-5-9-15(14)12-16;1-12-11-7-6-9-4-2-3-5-10(9)8-11/h1-12H;2-8H,1H3
InChIKeyCHNKYTCWAIYJQY-UHFFFAOYSA-N
XLogP7.36
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500362.47
LogP ≤ 57.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-methoxy-6-phenylnaphthalene
CID 11253308
2-methoxy-6-(4-methoxyphenyl)naphthalene
CID 11149734
2-methoxy-7-(2-phenylphenyl)naphthalene
CID 141340555
1-[4-(4-methoxyphenyl)phenyl]-3,5-diphenylbenzene
CID 176774050
anisole;1,1'-biphenyl;naphthalene
CID 161250692
1-methoxy-3-[4-(4-methoxyphenyl)phenyl]benzene
CID 25138852
2-(4-chlorophenyl)-7-methoxynaphthalene
CID 54239176
1-methoxy-4-phenylbenzene;methyloxidanium
CID 144616924
benzo[f]azulene
CID 13065869
2-(4-chlorophenyl)-6-methoxynaphthalene
CID 45156517
anisole;ethane;2-methoxynaphthalene;propane
CID 158674412
2-(3-fluorophenyl)-6-methoxynaphthalene
CID 45156519

Frequently Asked Questions

What is the IUPAC name of 2-methoxynaphthalene;2-phenylnaphthalene?
The IUPAC name of 2-methoxynaphthalene;2-phenylnaphthalene (CID 173269029) is 2-methoxynaphthalene;2-phenylnaphthalene.
What is the SMILES notation for 2-methoxynaphthalene;2-phenylnaphthalene?
The canonical SMILES for 2-methoxynaphthalene;2-phenylnaphthalene is COc1ccc2ccccc2c1.c1ccc(-c2ccc3ccccc3c2)cc1.
What is the InChIKey of 2-methoxynaphthalene;2-phenylnaphthalene?
The InChIKey is CHNKYTCWAIYJQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12.C11H10O/c1-2-6-13(7-3-1)16-11-10-14-8-4-5-9-15(14)12-16;1-12-11-7-6-9-4-2-3-5-10(9)8-11/h1-12H;2-8H,1H3.
What are the key properties of 2-methoxynaphthalene;2-phenylnaphthalene?
2-methoxynaphthalene;2-phenylnaphthalene has a molecular weight of 362.47 g/mol, XLogP of 7.36, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxynaphthalene;2-phenylnaphthalene is sourced from PubChem (CID 173269029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).