1-naphthalen-1-yl-3-phenylnaphthalen-2-ol

C26H18O — CID 11982733

IUPAC1-naphthalen-1-yl-3-phenylnaphthalen-2-ol
SMILESOc1c(-c2ccccc2)cc2ccccc2c1-c1cccc2ccccc12
InChIInChI=1S/C26H18O/c27-26-24(19-9-2-1-3-10-19)17-20-12-5-7-15-22(20)25(26)23-16-8-13-18-11-4-6-14-21(18)23/h1-17,27H
InChIKeyAVWBWHBFMGIRNG-UHFFFAOYSA-N
MW346.43 g/mol
LogP7.03
Rot. Bonds2

About 1-naphthalen-1-yl-3-phenylnaphthalen-2-ol

1-naphthalen-1-yl-3-phenylnaphthalen-2-ol (PubChem CID 11982733) has the molecular formula C26H18O and a molecular weight of 346.43 g/mol. Its IUPAC name is 1-naphthalen-1-yl-3-phenylnaphthalen-2-ol.

Molecular Properties

Compound Name1-naphthalen-1-yl-3-phenylnaphthalen-2-ol
PubChem CID11982733
Molecular FormulaC26H18O
Molecular Weight346.43 g/mol
Exact Mass346.14
IUPAC Name1-naphthalen-1-yl-3-phenylnaphthalen-2-ol
SMILESOc1c(-c2ccccc2)cc2ccccc2c1-c1cccc2ccccc12
InChIInChI=1S/C26H18O/c27-26-24(19-9-2-1-3-10-19)17-20-12-5-7-15-22(20)25(26)23-16-8-13-18-11-4-6-14-21(18)23/h1-17,27H
InChIKeyAVWBWHBFMGIRNG-UHFFFAOYSA-N
XLogP7.03
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms27
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500346.43
LogP ≤ 57.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-naphthalen-1-yl-3-phenylnaphthalen-2-ol?
The IUPAC name of 1-naphthalen-1-yl-3-phenylnaphthalen-2-ol (CID 11982733) is 1-naphthalen-1-yl-3-phenylnaphthalen-2-ol.
What is the SMILES notation for 1-naphthalen-1-yl-3-phenylnaphthalen-2-ol?
The canonical SMILES for 1-naphthalen-1-yl-3-phenylnaphthalen-2-ol is Oc1c(-c2ccccc2)cc2ccccc2c1-c1cccc2ccccc12.
What is the InChIKey of 1-naphthalen-1-yl-3-phenylnaphthalen-2-ol?
The InChIKey is AVWBWHBFMGIRNG-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H18O/c27-26-24(19-9-2-1-3-10-19)17-20-12-5-7-15-22(20)25(26)23-16-8-13-18-11-4-6-14-21(18)23/h1-17,27H.
What are the key properties of 1-naphthalen-1-yl-3-phenylnaphthalen-2-ol?
1-naphthalen-1-yl-3-phenylnaphthalen-2-ol has a molecular weight of 346.43 g/mol, XLogP of 7.03, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-naphthalen-1-yl-3-phenylnaphthalen-2-ol is sourced from PubChem (CID 11982733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).