1-(4-chloro-2-fluorophenyl)naphthalen-2-ol

C16H10ClFO — CID 146212373

IUPAC1-(4-chloro-2-fluorophenyl)naphthalen-2-ol
SMILESOc1ccc2ccccc2c1-c1ccc(Cl)cc1F
InChIInChI=1S/C16H10ClFO/c17-11-6-7-13(14(18)9-11)16-12-4-2-1-3-10(12)5-8-15(16)19/h1-9,19H
InChIKeyLIRBFSAJRIFUEV-UHFFFAOYSA-N
MW272.71 g/mol
LogP5.00
Rot. Bonds1

About 1-(4-chloro-2-fluorophenyl)naphthalen-2-ol

1-(4-chloro-2-fluorophenyl)naphthalen-2-ol (PubChem CID 146212373) has the molecular formula C16H10ClFO and a molecular weight of 272.71 g/mol. Its IUPAC name is 1-(4-chloro-2-fluorophenyl)naphthalen-2-ol.

Molecular Properties

Compound Name1-(4-chloro-2-fluorophenyl)naphthalen-2-ol
PubChem CID146212373
Molecular FormulaC16H10ClFO
Molecular Weight272.71 g/mol
Exact Mass272.04
IUPAC Name1-(4-chloro-2-fluorophenyl)naphthalen-2-ol
SMILESOc1ccc2ccccc2c1-c1ccc(Cl)cc1F
InChIInChI=1S/C16H10ClFO/c17-11-6-7-13(14(18)9-11)16-12-4-2-1-3-10(12)5-8-15(16)19/h1-9,19H
InChIKeyLIRBFSAJRIFUEV-UHFFFAOYSA-N
XLogP5.00
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500272.71
LogP ≤ 55.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(5-chloro-2-fluorophenyl)-2-methylnaphthalene
CID 146211188
1-(3-fluoro-4-hydroxyphenyl)naphthalen-2-ol
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5-chloro-2-(2-fluorophenyl)phenol
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tris(1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol);phosphorous acid
CID 173338729
4-(2-hydroxynaphthalen-1-yl)naphthalene-1-carbonitrile
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2-(4-fluoronaphthalen-1-yl)benzene-1,3-diol
CID 19593567
1-(2-hydroxynaphthalen-1-yl)naphthalen-2-ol;methoxymethane
CID 20848816
4-chloro-N-[4-hydroxy-3-(2-hydroxynaphthalen-1-yl)naphthalen-1-yl]benzenesulfonamide
CID 2269846
3-bromo-2-(4-chloro-2-fluorophenyl)-5-phenylphenol
CID 162532817
2-(2-chloro-6-fluorophenyl)naphthalen-1-ol
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1-fluoronaphthalen-2-ol
CID 11094948

Frequently Asked Questions

What is the IUPAC name of 1-(4-chloro-2-fluorophenyl)naphthalen-2-ol?
The IUPAC name of 1-(4-chloro-2-fluorophenyl)naphthalen-2-ol (CID 146212373) is 1-(4-chloro-2-fluorophenyl)naphthalen-2-ol.
What is the SMILES notation for 1-(4-chloro-2-fluorophenyl)naphthalen-2-ol?
The canonical SMILES for 1-(4-chloro-2-fluorophenyl)naphthalen-2-ol is Oc1ccc2ccccc2c1-c1ccc(Cl)cc1F.
What is the InChIKey of 1-(4-chloro-2-fluorophenyl)naphthalen-2-ol?
The InChIKey is LIRBFSAJRIFUEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10ClFO/c17-11-6-7-13(14(18)9-11)16-12-4-2-1-3-10(12)5-8-15(16)19/h1-9,19H.
What are the key properties of 1-(4-chloro-2-fluorophenyl)naphthalen-2-ol?
1-(4-chloro-2-fluorophenyl)naphthalen-2-ol has a molecular weight of 272.71 g/mol, XLogP of 5.00, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chloro-2-fluorophenyl)naphthalen-2-ol is sourced from PubChem (CID 146212373), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).