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

C14H12ClFO2 — CID 115956286

IUPAC[3-chloro-2-[(4-fluorophenyl)methoxy]phenyl]methanol
SMILESOCc1cccc(Cl)c1OCc1ccc(F)cc1
InChIInChI=1S/C14H12ClFO2/c15-13-3-1-2-11(8-17)14(13)18-9-10-4-6-12(16)7-5-10/h1-7,17H,8-9H2
InChIKeyYZLBBFNAAOCZQO-UHFFFAOYSA-N
MW266.70 g/mol
LogP3.55
Rot. Bonds4

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

[3-chloro-2-[(4-fluorophenyl)methoxy]phenyl]methanol (PubChem CID 115956286) has the molecular formula C14H12ClFO2 and a molecular weight of 266.70 g/mol. Its IUPAC name is [3-chloro-2-[(4-fluorophenyl)methoxy]phenyl]methanol.

Molecular Properties

Compound Name[3-chloro-2-[(4-fluorophenyl)methoxy]phenyl]methanol
PubChem CID115956286
Molecular FormulaC14H12ClFO2
Molecular Weight266.70 g/mol
Exact Mass266.05
IUPAC Name[3-chloro-2-[(4-fluorophenyl)methoxy]phenyl]methanol
SMILESOCc1cccc(Cl)c1OCc1ccc(F)cc1
InChIInChI=1S/C14H12ClFO2/c15-13-3-1-2-11(8-17)14(13)18-9-10-4-6-12(16)7-5-10/h1-7,17H,8-9H2
InChIKeyYZLBBFNAAOCZQO-UHFFFAOYSA-N
XLogP3.55
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.70
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[3-chloro-2-[(3,4-difluorophenyl)methoxy]phenyl]methanol
CID 112612722
[3-chloro-2-[(2-chloro-6-fluorophenyl)methoxy]phenyl]methanol
CID 112612622
[3-chloro-2-(4-fluorophenoxy)phenyl]methanol
CID 114067610
[3-chloro-2-[(3,5-dimethylphenyl)methoxy]phenyl]methanol
CID 112612639
[3-chloro-2-[(5-chloro-2-fluorophenyl)methoxy]phenyl]methanol
CID 103046982
[3,5-dichloro-4-[(4-fluorophenyl)methoxy]phenyl]methanol
CID 893259
4-[[2-fluoro-6-(hydroxymethyl)phenoxy]methyl]phenol
CID 112613126
[3-chloro-2-[(2-methoxyphenyl)methoxy]phenyl]methanol
CID 112612839
[2-[(2-chlorophenyl)methoxy]-3-fluorophenyl]methanol
CID 112613091
1-chloro-2-[[4-[(2-chloro-6-prop-2-enylphenoxy)methyl]phenyl]methoxy]-3-prop-2-enylbenzene
CID 59551586
[2,3-bis[(2-chlorophenyl)methoxy]phenyl]methanol
CID 23590539
[2-[(2,6-dichlorophenyl)methoxy]-5-fluoro-3-(hydroxymethyl)phenyl]methanol
CID 112788149

Frequently Asked Questions

What is the IUPAC name of [3-chloro-2-[(4-fluorophenyl)methoxy]phenyl]methanol?
The IUPAC name of [3-chloro-2-[(4-fluorophenyl)methoxy]phenyl]methanol (CID 115956286) is [3-chloro-2-[(4-fluorophenyl)methoxy]phenyl]methanol.
What is the SMILES notation for [3-chloro-2-[(4-fluorophenyl)methoxy]phenyl]methanol?
The canonical SMILES for [3-chloro-2-[(4-fluorophenyl)methoxy]phenyl]methanol is OCc1cccc(Cl)c1OCc1ccc(F)cc1.
What is the InChIKey of [3-chloro-2-[(4-fluorophenyl)methoxy]phenyl]methanol?
The InChIKey is YZLBBFNAAOCZQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12ClFO2/c15-13-3-1-2-11(8-17)14(13)18-9-10-4-6-12(16)7-5-10/h1-7,17H,8-9H2.
What are the key properties of [3-chloro-2-[(4-fluorophenyl)methoxy]phenyl]methanol?
[3-chloro-2-[(4-fluorophenyl)methoxy]phenyl]methanol has a molecular weight of 266.70 g/mol, XLogP of 3.55, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-chloro-2-[(4-fluorophenyl)methoxy]phenyl]methanol is sourced from PubChem (CID 115956286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).