8-(2-fluoro-6-nitrophenyl)naphthalen-1-ol

C16H10FNO3 — CID 162462407

IUPAC8-(2-fluoro-6-nitrophenyl)naphthalen-1-ol
SMILESO=[N+]([O-])c1cccc(F)c1-c1cccc2cccc(O)c12
InChIInChI=1S/C16H10FNO3/c17-12-7-3-8-13(18(20)21)16(12)11-6-1-4-10-5-2-9-14(19)15(10)11/h1-9,19H
InChIKeyQIEJVXFGMGXEAR-UHFFFAOYSA-N
MW283.26 g/mol
LogP4.26
Rot. Bonds2

About 8-(2-fluoro-6-nitrophenyl)naphthalen-1-ol

8-(2-fluoro-6-nitrophenyl)naphthalen-1-ol (PubChem CID 162462407) has the molecular formula C16H10FNO3 and a molecular weight of 283.26 g/mol. Its IUPAC name is 8-(2-fluoro-6-nitrophenyl)naphthalen-1-ol.

Molecular Properties

Compound Name8-(2-fluoro-6-nitrophenyl)naphthalen-1-ol
PubChem CID162462407
Molecular FormulaC16H10FNO3
Molecular Weight283.26 g/mol
Exact Mass283.06
IUPAC Name8-(2-fluoro-6-nitrophenyl)naphthalen-1-ol
SMILESO=[N+]([O-])c1cccc(F)c1-c1cccc2cccc(O)c12
InChIInChI=1S/C16H10FNO3/c17-12-7-3-8-13(18(20)21)16(12)11-6-1-4-10-5-2-9-14(19)15(10)11/h1-9,19H
InChIKeyQIEJVXFGMGXEAR-UHFFFAOYSA-N
XLogP4.26
TPSA63.37 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.26
LogP ≤ 54.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

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CID 11821842
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3-nitroacenaphthylene-1,2-dione
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2-fluoro-6-(4-methyl-3-nitrophenyl)phenol
CID 69242564
1,2-difluoro-3-(2-fluorophenyl)-4-nitrobenzene
CID 46314527
4-(2,3-difluorophenyl)-2-nitrophenol
CID 53221638
1,2,3,4,5-pentafluoro-6-(2-fluoro-3-nitrophenyl)benzene
CID 134617355
3-nitro-2-(2-propan-2-ylphenyl)phenol
CID 150628369
2-chloro-1-(18F)fluoro-3-nitrobenzene
CID 151209633
(2-hydroxy-6-nitrophenyl)mercury;hydrate
CID 21455177
2-fluoro-6-nitrobenzoic acid
CID 603758

Frequently Asked Questions

What is the IUPAC name of 8-(2-fluoro-6-nitrophenyl)naphthalen-1-ol?
The IUPAC name of 8-(2-fluoro-6-nitrophenyl)naphthalen-1-ol (CID 162462407) is 8-(2-fluoro-6-nitrophenyl)naphthalen-1-ol.
What is the SMILES notation for 8-(2-fluoro-6-nitrophenyl)naphthalen-1-ol?
The canonical SMILES for 8-(2-fluoro-6-nitrophenyl)naphthalen-1-ol is O=[N+]([O-])c1cccc(F)c1-c1cccc2cccc(O)c12.
What is the InChIKey of 8-(2-fluoro-6-nitrophenyl)naphthalen-1-ol?
The InChIKey is QIEJVXFGMGXEAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10FNO3/c17-12-7-3-8-13(18(20)21)16(12)11-6-1-4-10-5-2-9-14(19)15(10)11/h1-9,19H.
What are the key properties of 8-(2-fluoro-6-nitrophenyl)naphthalen-1-ol?
8-(2-fluoro-6-nitrophenyl)naphthalen-1-ol has a molecular weight of 283.26 g/mol, XLogP of 4.26, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 8-(2-fluoro-6-nitrophenyl)naphthalen-1-ol is sourced from PubChem (CID 162462407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).