1-(5-fluoro-2-nitrophenyl)naphthalene

C16H10FNO2 — CID 121246133

IUPAC1-(5-fluoro-2-nitrophenyl)naphthalene
SMILESO=[N+]([O-])c1ccc(F)cc1-c1cccc2ccccc12
InChIInChI=1S/C16H10FNO2/c17-12-8-9-16(18(19)20)15(10-12)14-7-3-5-11-4-1-2-6-13(11)14/h1-10H
InChIKeyBBZZMCCPRHMLFG-UHFFFAOYSA-N
MW267.26 g/mol
LogP4.55
Rot. Bonds2

About 1-(5-fluoro-2-nitrophenyl)naphthalene

1-(5-fluoro-2-nitrophenyl)naphthalene (PubChem CID 121246133) has the molecular formula C16H10FNO2 and a molecular weight of 267.26 g/mol. Its IUPAC name is 1-(5-fluoro-2-nitrophenyl)naphthalene.

Molecular Properties

Compound Name1-(5-fluoro-2-nitrophenyl)naphthalene
PubChem CID121246133
Molecular FormulaC16H10FNO2
Molecular Weight267.26 g/mol
Exact Mass267.07
IUPAC Name1-(5-fluoro-2-nitrophenyl)naphthalene
SMILESO=[N+]([O-])c1ccc(F)cc1-c1cccc2ccccc12
InChIInChI=1S/C16H10FNO2/c17-12-8-9-16(18(19)20)15(10-12)14-7-3-5-11-4-1-2-6-13(11)14/h1-10H
InChIKeyBBZZMCCPRHMLFG-UHFFFAOYSA-N
XLogP4.55
TPSA43.14 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.26
LogP ≤ 54.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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

3-naphthalen-1-yl-4-nitrophenol
CID 57178069
9-(3-naphthalen-1-yl-4-nitrophenyl)carbazole
CID 121299787
1-chloro-4-fluoro-2-(2-nitrophenyl)benzene
CID 142744710
5-fluoro-2-(2-nitronaphthalen-1-yl)benzaldehyde
CID 102106645
4-(2-nitrophenyl)benzo[c]phenanthrene
CID 154597914
CID 70188502
CID 70188502
1,2,3,4,5-pentachloro-6-(5-fluoro-2-nitrophenyl)benzene
CID 134630100
1-nitronaphthalene;hydrate
CID 174470741
4-fluoro-1-methoxy-2-(2-nitrophenyl)benzene
CID 22147723
2-naphthalen-1-yl-3-nitrothiophene
CID 46210339
3-(5-chloro-2-nitrophenyl)fluoranthene
CID 134301029
1,3-difluoro-5-(2-nitrophenyl)benzene
CID 134598355

Frequently Asked Questions

What is the IUPAC name of 1-(5-fluoro-2-nitrophenyl)naphthalene?
The IUPAC name of 1-(5-fluoro-2-nitrophenyl)naphthalene (CID 121246133) is 1-(5-fluoro-2-nitrophenyl)naphthalene.
What is the SMILES notation for 1-(5-fluoro-2-nitrophenyl)naphthalene?
The canonical SMILES for 1-(5-fluoro-2-nitrophenyl)naphthalene is O=[N+]([O-])c1ccc(F)cc1-c1cccc2ccccc12.
What is the InChIKey of 1-(5-fluoro-2-nitrophenyl)naphthalene?
The InChIKey is BBZZMCCPRHMLFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10FNO2/c17-12-8-9-16(18(19)20)15(10-12)14-7-3-5-11-4-1-2-6-13(11)14/h1-10H.
What are the key properties of 1-(5-fluoro-2-nitrophenyl)naphthalene?
1-(5-fluoro-2-nitrophenyl)naphthalene has a molecular weight of 267.26 g/mol, XLogP of 4.55, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-fluoro-2-nitrophenyl)naphthalene is sourced from PubChem (CID 121246133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).