1-(3-fluoropropyl)-4-phenylmethoxybenzene

C16H17FO — CID 83932928

IUPAC1-(3-fluoropropyl)-4-phenylmethoxybenzene
SMILESFCCCc1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C16H17FO/c17-12-4-7-14-8-10-16(11-9-14)18-13-15-5-2-1-3-6-15/h1-3,5-6,8-11H,4,7,12-13H2
InChIKeyVCDUAMZSGYSHIV-UHFFFAOYSA-N
MW244.31 g/mol
LogP4.17
Rot. Bonds6

About 1-(3-fluoropropyl)-4-phenylmethoxybenzene

1-(3-fluoropropyl)-4-phenylmethoxybenzene (PubChem CID 83932928) has the molecular formula C16H17FO and a molecular weight of 244.31 g/mol. Its IUPAC name is 1-(3-fluoropropyl)-4-phenylmethoxybenzene.

Molecular Properties

Compound Name1-(3-fluoropropyl)-4-phenylmethoxybenzene
PubChem CID83932928
Molecular FormulaC16H17FO
Molecular Weight244.31 g/mol
Exact Mass244.13
IUPAC Name1-(3-fluoropropyl)-4-phenylmethoxybenzene
SMILESFCCCc1ccc(OCc2ccccc2)cc1
InChIInChI=1S/C16H17FO/c17-12-4-7-14-8-10-16(11-9-14)18-13-15-5-2-1-3-6-15/h1-3,5-6,8-11H,4,7,12-13H2
InChIKeyVCDUAMZSGYSHIV-UHFFFAOYSA-N
XLogP4.17
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.31
LogP ≤ 54.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

lithium 3-(4-phenylmethoxyphenyl)propan-1-olate
CID 70590872
2-[4-[3-(4-phenylmethoxyphenoxy)propoxy]phenyl]ethanamine
CID 170868663
1-(3-methoxypropyl)-4-phenylmethoxybenzene
CID 70548198
1-(8-methoxyoctyl)-4-phenylmethoxybenzene
CID 15052396
1-(benzylperoxymethyl)-4-[[4-[(4-phenylmethoxyphenyl)methoxy]phenyl]methoxy]benzene
CID 156694250
1-benzyl-4-[[4-(3-hydroperoxypropyl)phenoxy]methyl]benzene
CID 143625778
6-(4-phenylmethoxyphenyl)hexanoic acid
CID 138486172
1-phenylmethoxy-4-[9-(4-phenylmethoxyphenoxy)nonoxy]benzene
CID 43835980
1-(3-methylbut-3-enyl)-4-phenylmethoxybenzene
CID 146002662
2-methyl-N-[3-(4-phenylmethoxyphenyl)propyl]propan-2-amine
CID 56995593
5-(4-phenylmethoxyphenyl)pentyl formate
CID 87852449
1-methoxy-4-[(4-phenylmethoxyphenoxy)methyl]benzene
CID 12029541

Frequently Asked Questions

What is the IUPAC name of 1-(3-fluoropropyl)-4-phenylmethoxybenzene?
The IUPAC name of 1-(3-fluoropropyl)-4-phenylmethoxybenzene (CID 83932928) is 1-(3-fluoropropyl)-4-phenylmethoxybenzene.
What is the SMILES notation for 1-(3-fluoropropyl)-4-phenylmethoxybenzene?
The canonical SMILES for 1-(3-fluoropropyl)-4-phenylmethoxybenzene is FCCCc1ccc(OCc2ccccc2)cc1.
What is the InChIKey of 1-(3-fluoropropyl)-4-phenylmethoxybenzene?
The InChIKey is VCDUAMZSGYSHIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17FO/c17-12-4-7-14-8-10-16(11-9-14)18-13-15-5-2-1-3-6-15/h1-3,5-6,8-11H,4,7,12-13H2.
What are the key properties of 1-(3-fluoropropyl)-4-phenylmethoxybenzene?
1-(3-fluoropropyl)-4-phenylmethoxybenzene has a molecular weight of 244.31 g/mol, XLogP of 4.17, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluoropropyl)-4-phenylmethoxybenzene is sourced from PubChem (CID 83932928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).