2-(4-methylnaphthalen-1-yl)phenol

C17H14O — CID 53405208

IUPAC2-(4-methylnaphthalen-1-yl)phenol
SMILESCc1ccc(-c2ccccc2O)c2ccccc12
InChIInChI=1S/C17H14O/c1-12-10-11-15(14-7-3-2-6-13(12)14)16-8-4-5-9-17(16)18/h2-11,18H,1H3
InChIKeyBGRCDYUFITXAFD-UHFFFAOYSA-N
MW234.30 g/mol
LogP4.52
Rot. Bonds1

About 2-(4-methylnaphthalen-1-yl)phenol

2-(4-methylnaphthalen-1-yl)phenol (PubChem CID 53405208) has the molecular formula C17H14O and a molecular weight of 234.30 g/mol. Its IUPAC name is 2-(4-methylnaphthalen-1-yl)phenol.

Molecular Properties

Compound Name2-(4-methylnaphthalen-1-yl)phenol
PubChem CID53405208
Molecular FormulaC17H14O
Molecular Weight234.30 g/mol
Exact Mass234.10
IUPAC Name2-(4-methylnaphthalen-1-yl)phenol
SMILESCc1ccc(-c2ccccc2O)c2ccccc12
InChIInChI=1S/C17H14O/c1-12-10-11-15(14-7-3-2-6-13(12)14)16-8-4-5-9-17(16)18/h2-11,18H,1H3
InChIKeyBGRCDYUFITXAFD-UHFFFAOYSA-N
XLogP4.52
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 54.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-methyl-4-(4-methylnaphthalen-1-yl)phenol
CID 53405300
2-(4-fluoronaphthalen-1-yl)phenol
CID 174532409
2-(4-chloronaphthalen-1-yl)phenol
CID 175271825
1-methyl-4-[4-(4-methylphenyl)naphthalen-1-yl]naphthalene
CID 123804574
2-(3-chloro-2,4-dimethylphenyl)phenol
CID 157205904
2-methyl-3-(4-methylnaphthalen-1-yl)benzoic acid
CID 53405299
2-(2-naphthalen-1-ylphenyl)phenol
CID 122204114
1-[2-chloro-6-(4-methylnaphthalen-1-yl)phenyl]-4-methylnaphthalene
CID 177097132
1-methyl-4-(2-nitrophenyl)naphthalene
CID 66585246
2-(2-hydroxyphenyl)-3,6-dimethylphenol
CID 101298934
4-(2-hydroxyphenyl)-2-methylbenzene-1,3-diol
CID 101299684
ethane;2-(2-methylphenyl)phenol;propane
CID 142042568

Frequently Asked Questions

What is the IUPAC name of 2-(4-methylnaphthalen-1-yl)phenol?
The IUPAC name of 2-(4-methylnaphthalen-1-yl)phenol (CID 53405208) is 2-(4-methylnaphthalen-1-yl)phenol.
What is the SMILES notation for 2-(4-methylnaphthalen-1-yl)phenol?
The canonical SMILES for 2-(4-methylnaphthalen-1-yl)phenol is Cc1ccc(-c2ccccc2O)c2ccccc12.
What is the InChIKey of 2-(4-methylnaphthalen-1-yl)phenol?
The InChIKey is BGRCDYUFITXAFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14O/c1-12-10-11-15(14-7-3-2-6-13(12)14)16-8-4-5-9-17(16)18/h2-11,18H,1H3.
What are the key properties of 2-(4-methylnaphthalen-1-yl)phenol?
2-(4-methylnaphthalen-1-yl)phenol has a molecular weight of 234.30 g/mol, XLogP of 4.52, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylnaphthalen-1-yl)phenol is sourced from PubChem (CID 53405208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).