7-[(5-chloro-2-fluorophenyl)methoxy]naphthalen-2-ol

C17H12ClFO2 — CID 103047091

IUPAC7-[(5-chloro-2-fluorophenyl)methoxy]naphthalen-2-ol
SMILESOc1ccc2ccc(OCc3cc(Cl)ccc3F)cc2c1
InChIInChI=1S/C17H12ClFO2/c18-14-3-6-17(19)13(7-14)10-21-16-5-2-11-1-4-15(20)8-12(11)9-16/h1-9,20H,10H2
InChIKeyJHYFGWLOORMBGT-UHFFFAOYSA-N
MW302.73 g/mol
LogP4.92
Rot. Bonds3

About 7-[(5-chloro-2-fluorophenyl)methoxy]naphthalen-2-ol

7-[(5-chloro-2-fluorophenyl)methoxy]naphthalen-2-ol (PubChem CID 103047091) has the molecular formula C17H12ClFO2 and a molecular weight of 302.73 g/mol. Its IUPAC name is 7-[(5-chloro-2-fluorophenyl)methoxy]naphthalen-2-ol.

Molecular Properties

Compound Name7-[(5-chloro-2-fluorophenyl)methoxy]naphthalen-2-ol
PubChem CID103047091
Molecular FormulaC17H12ClFO2
Molecular Weight302.73 g/mol
Exact Mass302.05
IUPAC Name7-[(5-chloro-2-fluorophenyl)methoxy]naphthalen-2-ol
SMILESOc1ccc2ccc(OCc3cc(Cl)ccc3F)cc2c1
InChIInChI=1S/C17H12ClFO2/c18-14-3-6-17(19)13(7-14)10-21-16-5-2-11-1-4-15(20)8-12(11)9-16/h1-9,20H,10H2
InChIKeyJHYFGWLOORMBGT-UHFFFAOYSA-N
XLogP4.92
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.73
LogP ≤ 54.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-[(5-chloro-2-fluorophenyl)methoxy]naphthalen-2-ol?
The IUPAC name of 7-[(5-chloro-2-fluorophenyl)methoxy]naphthalen-2-ol (CID 103047091) is 7-[(5-chloro-2-fluorophenyl)methoxy]naphthalen-2-ol.
What is the SMILES notation for 7-[(5-chloro-2-fluorophenyl)methoxy]naphthalen-2-ol?
The canonical SMILES for 7-[(5-chloro-2-fluorophenyl)methoxy]naphthalen-2-ol is Oc1ccc2ccc(OCc3cc(Cl)ccc3F)cc2c1.
What is the InChIKey of 7-[(5-chloro-2-fluorophenyl)methoxy]naphthalen-2-ol?
The InChIKey is JHYFGWLOORMBGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12ClFO2/c18-14-3-6-17(19)13(7-14)10-21-16-5-2-11-1-4-15(20)8-12(11)9-16/h1-9,20H,10H2.
What are the key properties of 7-[(5-chloro-2-fluorophenyl)methoxy]naphthalen-2-ol?
7-[(5-chloro-2-fluorophenyl)methoxy]naphthalen-2-ol has a molecular weight of 302.73 g/mol, XLogP of 4.92, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[(5-chloro-2-fluorophenyl)methoxy]naphthalen-2-ol is sourced from PubChem (CID 103047091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).