1-fluoro-2-[(2-methylphenyl)methoxy]benzene

C14H13FO — CID 60627765

IUPAC1-fluoro-2-[(2-methylphenyl)methoxy]benzene
SMILESCc1ccccc1COc1ccccc1F
InChIInChI=1S/C14H13FO/c1-11-6-2-3-7-12(11)10-16-14-9-5-4-8-13(14)15/h2-9H,10H2,1H3
InChIKeyZHQASVXKPTULGH-UHFFFAOYSA-N
MW216.25 g/mol
LogP3.71
Rot. Bonds3

About 1-fluoro-2-[(2-methylphenyl)methoxy]benzene

1-fluoro-2-[(2-methylphenyl)methoxy]benzene (PubChem CID 60627765) has the molecular formula C14H13FO and a molecular weight of 216.25 g/mol. Its IUPAC name is 1-fluoro-2-[(2-methylphenyl)methoxy]benzene.

Molecular Properties

Compound Name1-fluoro-2-[(2-methylphenyl)methoxy]benzene
PubChem CID60627765
Molecular FormulaC14H13FO
Molecular Weight216.25 g/mol
Exact Mass216.10
IUPAC Name1-fluoro-2-[(2-methylphenyl)methoxy]benzene
SMILESCc1ccccc1COc1ccccc1F
InChIInChI=1S/C14H13FO/c1-11-6-2-3-7-12(11)10-16-14-9-5-4-8-13(14)15/h2-9H,10H2,1H3
InChIKeyZHQASVXKPTULGH-UHFFFAOYSA-N
XLogP3.71
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.25
LogP ≤ 53.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1,2-difluoro-3-[(2-fluoro-3-methylphenoxy)methyl]benzene
CID 107661926
4-(chloromethyl)-2-fluoro-1-[(2-methylphenyl)methoxy]benzene
CID 107691185
[5-fluoro-2-[(2-methylphenyl)methoxy]phenyl]methanol
CID 107698567
[4-[(2-fluorophenoxy)methyl]-5-methylfuran-2-yl]methanamine
CID 62454744
1-[[2-[(2,3-difluorophenoxy)methyl]phenyl]methoxy]-2,3-difluorobenzene
CID 174920306
1-ethyl-3-[(2-fluorophenoxy)methyl]-4-methylindole
CID 117184639
4-fluoro-3-[(2-methylphenoxy)methyl]-1-benzothiophene
CID 117170884
5-fluoro-2-[(2-methylphenyl)methoxy]benzoic acid
CID 113281422
7-fluoro-3-[(2-methylphenoxy)methyl]-1-benzofuran
CID 117181030
1-[4-fluoro-2-[(2-methylphenyl)methoxy]phenyl]ethanol
CID 55147459
3-[(2-fluorophenoxy)methyl]pyridin-2-amine
CID 62464415
(1S)-1-[2-[(2-methylphenyl)methoxy]phenyl]ethanamine
CID 30079943

Frequently Asked Questions

What is the IUPAC name of 1-fluoro-2-[(2-methylphenyl)methoxy]benzene?
The IUPAC name of 1-fluoro-2-[(2-methylphenyl)methoxy]benzene (CID 60627765) is 1-fluoro-2-[(2-methylphenyl)methoxy]benzene.
What is the SMILES notation for 1-fluoro-2-[(2-methylphenyl)methoxy]benzene?
The canonical SMILES for 1-fluoro-2-[(2-methylphenyl)methoxy]benzene is Cc1ccccc1COc1ccccc1F.
What is the InChIKey of 1-fluoro-2-[(2-methylphenyl)methoxy]benzene?
The InChIKey is ZHQASVXKPTULGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13FO/c1-11-6-2-3-7-12(11)10-16-14-9-5-4-8-13(14)15/h2-9H,10H2,1H3.
What are the key properties of 1-fluoro-2-[(2-methylphenyl)methoxy]benzene?
1-fluoro-2-[(2-methylphenyl)methoxy]benzene has a molecular weight of 216.25 g/mol, XLogP of 3.71, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-fluoro-2-[(2-methylphenyl)methoxy]benzene is sourced from PubChem (CID 60627765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).