1-(4-fluorobutyl)naphthalene

C14H15F — CID 174977280

IUPAC1-(4-fluorobutyl)naphthalene
SMILESFCCCCc1cccc2ccccc12
InChIInChI=1S/C14H15F/c15-11-4-3-7-13-9-5-8-12-6-1-2-10-14(12)13/h1-2,5-6,8-10H,3-4,7,11H2
InChIKeyRVXJMKMJAMTCCM-UHFFFAOYSA-N
MW202.27 g/mol
LogP4.13
Rot. Bonds4

About 1-(4-fluorobutyl)naphthalene

1-(4-fluorobutyl)naphthalene (PubChem CID 174977280) has the molecular formula C14H15F and a molecular weight of 202.27 g/mol. Its IUPAC name is 1-(4-fluorobutyl)naphthalene.

Molecular Properties

Compound Name1-(4-fluorobutyl)naphthalene
PubChem CID174977280
Molecular FormulaC14H15F
Molecular Weight202.27 g/mol
Exact Mass202.12
IUPAC Name1-(4-fluorobutyl)naphthalene
SMILESFCCCCc1cccc2ccccc12
InChIInChI=1S/C14H15F/c15-11-4-3-7-13-9-5-8-12-6-1-2-10-14(12)13/h1-2,5-6,8-10H,3-4,7,11H2
InChIKeyRVXJMKMJAMTCCM-UHFFFAOYSA-N
XLogP4.13
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.27
LogP ≤ 54.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

8-naphthalen-1-yloctan-1-amine
CID 100987116
1-tetradecylnaphthalene
CID 14402128
3-naphthalen-1-ylpropan-1-ol
CID 14711518
1-[3-(3-naphthalen-1-ylpropoxy)propyl]naphthalene
CID 139748426
1-butylnaphthalene;ethane
CID 142087052
1-(4-methoxybutyl)naphthalene
CID 69278949
potassium;hydride;1-octylnaphthalene
CID 173443599
azane;1-butylnaphthalene;methane
CID 174691035
5-naphthalen-1-ylpentyl thiohypochlorite
CID 139608477
2-methyl-5-naphthalen-1-ylpentan-2-amine
CID 116925299
1-non-8-enylnaphthalene
CID 101304361
N,N-dimethyl-16-naphthalen-1-ylhexadecan-1-amine;hydrochloride
CID 174059419

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorobutyl)naphthalene?
The IUPAC name of 1-(4-fluorobutyl)naphthalene (CID 174977280) is 1-(4-fluorobutyl)naphthalene.
What is the SMILES notation for 1-(4-fluorobutyl)naphthalene?
The canonical SMILES for 1-(4-fluorobutyl)naphthalene is FCCCCc1cccc2ccccc12.
What is the InChIKey of 1-(4-fluorobutyl)naphthalene?
The InChIKey is RVXJMKMJAMTCCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15F/c15-11-4-3-7-13-9-5-8-12-6-1-2-10-14(12)13/h1-2,5-6,8-10H,3-4,7,11H2.
What are the key properties of 1-(4-fluorobutyl)naphthalene?
1-(4-fluorobutyl)naphthalene has a molecular weight of 202.27 g/mol, XLogP of 4.13, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorobutyl)naphthalene is sourced from PubChem (CID 174977280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).