1-fluoro-4-[(2-methoxyphenoxy)methyl]benzene

C14H13FO2 — CID 957472

IUPAC1-fluoro-4-[(2-methoxyphenoxy)methyl]benzene
SMILESCOc1ccccc1OCc1ccc(F)cc1
InChIInChI=1S/C14H13FO2/c1-16-13-4-2-3-5-14(13)17-10-11-6-8-12(15)9-7-11/h2-9H,10H2,1H3
InChIKeyFTRHAGJHQPNBKM-UHFFFAOYSA-N
MW232.25 g/mol
LogP3.41
Rot. Bonds4

About 1-fluoro-4-[(2-methoxyphenoxy)methyl]benzene

1-fluoro-4-[(2-methoxyphenoxy)methyl]benzene (PubChem CID 957472) has the molecular formula C14H13FO2 and a molecular weight of 232.25 g/mol. Its IUPAC name is 1-fluoro-4-[(2-methoxyphenoxy)methyl]benzene.

Molecular Properties

Compound Name1-fluoro-4-[(2-methoxyphenoxy)methyl]benzene
PubChem CID957472
Molecular FormulaC14H13FO2
Molecular Weight232.25 g/mol
Exact Mass232.09
IUPAC Name1-fluoro-4-[(2-methoxyphenoxy)methyl]benzene
SMILESCOc1ccccc1OCc1ccc(F)cc1
InChIInChI=1S/C14H13FO2/c1-16-13-4-2-3-5-14(13)17-10-11-6-8-12(15)9-7-11/h2-9H,10H2,1H3
InChIKeyFTRHAGJHQPNBKM-UHFFFAOYSA-N
XLogP3.41
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.25
LogP ≤ 53.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-iodo-4-[(2-methoxyphenoxy)methyl]benzene
CID 65490532
1-methoxy-2-[(4-phenylphenyl)methoxy]benzene
CID 67858860
[4-[(4-fluorophenyl)methoxy]-3-methoxyphenyl]methanamine
CID 16774045
2-[(4-fluorophenyl)methoxy]phenol
CID 43143460
1-[(4-fluorophenyl)methoxy]-2-methoxy-4-propan-2-ylbenzene
CID 130325597
1-[(4-fluorophenyl)methyl]-4-[(4-methoxy-3-phenylmethoxyphenyl)methyl]piperazine-1,4-diium
CID 7334786
N-[[4-[(4-fluorophenyl)methoxy]-3-methoxyphenyl]methyl]-2-phenylethanamine
CID 4715731
2-methoxy-4-[(2-methoxyphenoxy)methyl]phenol
CID 71421092
1-[2-[(4-fluorophenyl)methoxy]-3-methoxyphenyl]ethanol
CID 83951061
1-fluoro-4-[2-[(4-methylphenyl)methoxy]phenyl]benzene
CID 123297454
1-[4-[(4-fluorophenyl)methoxy]-3-methoxyphenyl]-N-(pyridin-2-ylmethyl)methanamine
CID 4720336
1-fluoro-4-(phenoxymethyl)benzene
CID 957495

Frequently Asked Questions

What is the IUPAC name of 1-fluoro-4-[(2-methoxyphenoxy)methyl]benzene?
The IUPAC name of 1-fluoro-4-[(2-methoxyphenoxy)methyl]benzene (CID 957472) is 1-fluoro-4-[(2-methoxyphenoxy)methyl]benzene.
What is the SMILES notation for 1-fluoro-4-[(2-methoxyphenoxy)methyl]benzene?
The canonical SMILES for 1-fluoro-4-[(2-methoxyphenoxy)methyl]benzene is COc1ccccc1OCc1ccc(F)cc1.
What is the InChIKey of 1-fluoro-4-[(2-methoxyphenoxy)methyl]benzene?
The InChIKey is FTRHAGJHQPNBKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13FO2/c1-16-13-4-2-3-5-14(13)17-10-11-6-8-12(15)9-7-11/h2-9H,10H2,1H3.
What are the key properties of 1-fluoro-4-[(2-methoxyphenoxy)methyl]benzene?
1-fluoro-4-[(2-methoxyphenoxy)methyl]benzene has a molecular weight of 232.25 g/mol, XLogP of 3.41, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-4-[(2-methoxyphenoxy)methyl]benzene is sourced from PubChem (CID 957472), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).