1-fluoro-4-(3-propylphenoxy)benzene

C15H15FO — CID 54416846

IUPAC1-fluoro-4-(3-propylphenoxy)benzene
SMILESCCCc1cccc(Oc2ccc(F)cc2)c1
InChIInChI=1S/C15H15FO/c1-2-4-12-5-3-6-15(11-12)17-14-9-7-13(16)8-10-14/h3,5-11H,2,4H2,1H3
InChIKeyLEJICIQUWYMVDV-UHFFFAOYSA-N
MW230.28 g/mol
LogP4.57
Rot. Bonds4

About 1-fluoro-4-(3-propylphenoxy)benzene

1-fluoro-4-(3-propylphenoxy)benzene (PubChem CID 54416846) has the molecular formula C15H15FO and a molecular weight of 230.28 g/mol. Its IUPAC name is 1-fluoro-4-(3-propylphenoxy)benzene.

Molecular Properties

Compound Name1-fluoro-4-(3-propylphenoxy)benzene
PubChem CID54416846
Molecular FormulaC15H15FO
Molecular Weight230.28 g/mol
Exact Mass230.11
IUPAC Name1-fluoro-4-(3-propylphenoxy)benzene
SMILESCCCc1cccc(Oc2ccc(F)cc2)c1
InChIInChI=1S/C15H15FO/c1-2-4-12-5-3-6-15(11-12)17-14-9-7-13(16)8-10-14/h3,5-11H,2,4H2,1H3
InChIKeyLEJICIQUWYMVDV-UHFFFAOYSA-N
XLogP4.57
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.28
LogP ≤ 54.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-fluoro-4-[3-(6-phenylhexyl)phenoxy]benzene
CID 58531395
1-pentyl-3-(4-propylphenoxy)benzene
CID 58062247
1-methoxy-3-(3-propylphenoxy)benzene
CID 153343611
1-(3-iodopropyl)-3-(4-propylphenoxy)benzene
CID 25223077
1-fluoro-4-[3-[3-[3-[3-(4-fluorophenoxy)phenoxy]phenoxy]phenoxy]phenoxy]benzene
CID 22338364
2-[3-(4-fluorophenoxy)phenyl]acetaldehyde
CID 170962590
N-[[3-(4-propylphenoxy)phenyl]methyl]ethanamine
CID 63942334
1-methoxy-3-propylbenzene
CID 14270128
2-[3-(4-fluorophenoxy)phenyl]acetic acid
CID 138754182
1-phenoxy-3-[2-(3-phenoxyphenyl)ethyl]benzene
CID 3046200
1-fluoro-4-[3-[4-methyl-4-(3-methylphenyl)pentyl]phenoxy]benzene
CID 21269746
2-chloro-4-(3-propylphenoxy)benzaldehyde
CID 58022595

Frequently Asked Questions

What is the IUPAC name of 1-fluoro-4-(3-propylphenoxy)benzene?
The IUPAC name of 1-fluoro-4-(3-propylphenoxy)benzene (CID 54416846) is 1-fluoro-4-(3-propylphenoxy)benzene.
What is the SMILES notation for 1-fluoro-4-(3-propylphenoxy)benzene?
The canonical SMILES for 1-fluoro-4-(3-propylphenoxy)benzene is CCCc1cccc(Oc2ccc(F)cc2)c1.
What is the InChIKey of 1-fluoro-4-(3-propylphenoxy)benzene?
The InChIKey is LEJICIQUWYMVDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FO/c1-2-4-12-5-3-6-15(11-12)17-14-9-7-13(16)8-10-14/h3,5-11H,2,4H2,1H3.
What are the key properties of 1-fluoro-4-(3-propylphenoxy)benzene?
1-fluoro-4-(3-propylphenoxy)benzene has a molecular weight of 230.28 g/mol, XLogP of 4.57, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-4-(3-propylphenoxy)benzene is sourced from PubChem (CID 54416846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).