1-fluoro-3-(methoxymethyl)-5-phenylmethoxybenzene

C15H15FO2 — CID 118070659

IUPAC1-fluoro-3-(methoxymethyl)-5-phenylmethoxybenzene
SMILESCOCc1cc(F)cc(OCc2ccccc2)c1
InChIInChI=1S/C15H15FO2/c1-17-10-13-7-14(16)9-15(8-13)18-11-12-5-3-2-4-6-12/h2-9H,10-11H2,1H3
InChIKeyUXLXWXWNZNXBFW-UHFFFAOYSA-N
MW246.28 g/mol
LogP3.55
Rot. Bonds5

About 1-fluoro-3-(methoxymethyl)-5-phenylmethoxybenzene

1-fluoro-3-(methoxymethyl)-5-phenylmethoxybenzene (PubChem CID 118070659) has the molecular formula C15H15FO2 and a molecular weight of 246.28 g/mol. Its IUPAC name is 1-fluoro-3-(methoxymethyl)-5-phenylmethoxybenzene.

Molecular Properties

Compound Name1-fluoro-3-(methoxymethyl)-5-phenylmethoxybenzene
PubChem CID118070659
Molecular FormulaC15H15FO2
Molecular Weight246.28 g/mol
Exact Mass246.11
IUPAC Name1-fluoro-3-(methoxymethyl)-5-phenylmethoxybenzene
SMILESCOCc1cc(F)cc(OCc2ccccc2)c1
InChIInChI=1S/C15H15FO2/c1-17-10-13-7-14(16)9-15(8-13)18-11-12-5-3-2-4-6-12/h2-9H,10-11H2,1H3
InChIKeyUXLXWXWNZNXBFW-UHFFFAOYSA-N
XLogP3.55
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.28
LogP ≤ 53.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(methoxymethyl)-3-phenylmethoxybenzene
CID 59224255
[3-fluoro-5-[[3-(methoxymethyl)phenoxy]methyl]phenyl]boronic acid
CID 79700938
1,3-bis[[3,5-bis[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methoxy]phenyl]methoxy]-5-methylbenzene
CID 102395902
ethane;3-fluoro-5-phenylmethoxybenzoic acid
CID 144722944
3-fluoro-5-phenylmethoxybenzoic acid
CID 18971714
1-[(3-ethylphenoxy)methyl]-3,5-difluorobenzene
CID 105409859
methoxymethylbenzene;silane
CID 174277199
methoxymethylbenzene;vanadium
CID 167445376
1,3-difluoro-2-methyl-5-phenylmethoxybenzene;ethane
CID 142106571
9-[4-[[3,5-bis(phenoxymethyl)phenoxy]methyl]phenyl]-10-[4-[[3-[[4-[10-[4-[[3,5-bis(phenoxymethyl)phenoxy]methyl]phenyl]anthracen-9-yl]phenyl]methoxy]-5-(methoxymethyl)phenoxy]methyl]phenyl]anthracene
CID 90192995
1-bromo-3-fluoro-5-phenylmethoxybenzene;phenylmethanol
CID 70121150
3-fluoro-5-phenylmethoxybenzamide
CID 155798135

Frequently Asked Questions

What is the IUPAC name of 1-fluoro-3-(methoxymethyl)-5-phenylmethoxybenzene?
The IUPAC name of 1-fluoro-3-(methoxymethyl)-5-phenylmethoxybenzene (CID 118070659) is 1-fluoro-3-(methoxymethyl)-5-phenylmethoxybenzene.
What is the SMILES notation for 1-fluoro-3-(methoxymethyl)-5-phenylmethoxybenzene?
The canonical SMILES for 1-fluoro-3-(methoxymethyl)-5-phenylmethoxybenzene is COCc1cc(F)cc(OCc2ccccc2)c1.
What is the InChIKey of 1-fluoro-3-(methoxymethyl)-5-phenylmethoxybenzene?
The InChIKey is UXLXWXWNZNXBFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FO2/c1-17-10-13-7-14(16)9-15(8-13)18-11-12-5-3-2-4-6-12/h2-9H,10-11H2,1H3.
What are the key properties of 1-fluoro-3-(methoxymethyl)-5-phenylmethoxybenzene?
1-fluoro-3-(methoxymethyl)-5-phenylmethoxybenzene has a molecular weight of 246.28 g/mol, XLogP of 3.55, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-3-(methoxymethyl)-5-phenylmethoxybenzene is sourced from PubChem (CID 118070659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).