[2-[(2-chloro-4-methylphenyl)methoxy]-3-fluorophenyl]methanol

C15H14ClFO2 — CID 106864412

IUPAC[2-[(2-chloro-4-methylphenyl)methoxy]-3-fluorophenyl]methanol
SMILESCc1ccc(COc2c(F)cccc2CO)c(Cl)c1
InChIInChI=1S/C15H14ClFO2/c1-10-5-6-12(13(16)7-10)9-19-15-11(8-18)3-2-4-14(15)17/h2-7,18H,8-9H2,1H3
InChIKeyYRMIEDZTGKPMOQ-UHFFFAOYSA-N
MW280.73 g/mol
LogP3.86
Rot. Bonds4

About [2-[(2-chloro-4-methylphenyl)methoxy]-3-fluorophenyl]methanol

[2-[(2-chloro-4-methylphenyl)methoxy]-3-fluorophenyl]methanol (PubChem CID 106864412) has the molecular formula C15H14ClFO2 and a molecular weight of 280.73 g/mol. Its IUPAC name is [2-[(2-chloro-4-methylphenyl)methoxy]-3-fluorophenyl]methanol.

Molecular Properties

Compound Name[2-[(2-chloro-4-methylphenyl)methoxy]-3-fluorophenyl]methanol
PubChem CID106864412
Molecular FormulaC15H14ClFO2
Molecular Weight280.73 g/mol
Exact Mass280.07
IUPAC Name[2-[(2-chloro-4-methylphenyl)methoxy]-3-fluorophenyl]methanol
SMILESCc1ccc(COc2c(F)cccc2CO)c(Cl)c1
InChIInChI=1S/C15H14ClFO2/c1-10-5-6-12(13(16)7-10)9-19-15-11(8-18)3-2-4-14(15)17/h2-7,18H,8-9H2,1H3
InChIKeyYRMIEDZTGKPMOQ-UHFFFAOYSA-N
XLogP3.86
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.73
LogP ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[2-[(2-chlorophenyl)methoxy]-3-fluorophenyl]methanol
CID 112613091
[2-[(2,5-dichlorophenyl)methoxy]-3-fluorophenyl]methanol
CID 112612937
[2-[(4-bromo-2-fluorophenyl)methoxy]-3-fluorophenyl]methanol
CID 112613188
1-(bromomethyl)-2-[(2-chloro-4-fluorophenyl)methoxy]-3-fluorobenzene
CID 112614047
2-[(2-chloro-4-methylphenyl)methoxy]-6-fluorobenzenecarbothioamide
CID 106863550
1-[(2-chloro-4-methylphenyl)methoxy]naphthalene
CID 106870276
[3-chloro-2-[(5-chloro-2-fluorophenyl)methoxy]phenyl]methanol
CID 103046982
[2-[(3-chlorothiophen-2-yl)methoxy]-3-fluorophenyl]methanol
CID 112749411
1-[4-[(2-chloro-4-methylphenyl)methoxy]-3,5-difluorophenyl]-N-methylmethanamine
CID 106861886
[3-chloro-2-[(2-chloro-6-fluorophenyl)methoxy]phenyl]methanol
CID 112612622
4-[[2-fluoro-6-(hydroxymethyl)phenoxy]methyl]phenol
CID 112613126
[3-chloro-2-[(3,5-dimethylphenyl)methoxy]phenyl]methanol
CID 112612639

Frequently Asked Questions

What is the IUPAC name of [2-[(2-chloro-4-methylphenyl)methoxy]-3-fluorophenyl]methanol?
The IUPAC name of [2-[(2-chloro-4-methylphenyl)methoxy]-3-fluorophenyl]methanol (CID 106864412) is [2-[(2-chloro-4-methylphenyl)methoxy]-3-fluorophenyl]methanol.
What is the SMILES notation for [2-[(2-chloro-4-methylphenyl)methoxy]-3-fluorophenyl]methanol?
The canonical SMILES for [2-[(2-chloro-4-methylphenyl)methoxy]-3-fluorophenyl]methanol is Cc1ccc(COc2c(F)cccc2CO)c(Cl)c1.
What is the InChIKey of [2-[(2-chloro-4-methylphenyl)methoxy]-3-fluorophenyl]methanol?
The InChIKey is YRMIEDZTGKPMOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClFO2/c1-10-5-6-12(13(16)7-10)9-19-15-11(8-18)3-2-4-14(15)17/h2-7,18H,8-9H2,1H3.
What are the key properties of [2-[(2-chloro-4-methylphenyl)methoxy]-3-fluorophenyl]methanol?
[2-[(2-chloro-4-methylphenyl)methoxy]-3-fluorophenyl]methanol has a molecular weight of 280.73 g/mol, XLogP of 3.86, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(2-chloro-4-methylphenyl)methoxy]-3-fluorophenyl]methanol is sourced from PubChem (CID 106864412), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).