[3-chloro-2-[(5-chloro-2-fluorophenyl)methoxy]phenyl]methanol

C14H11Cl2FO2 — CID 103046982

IUPAC[3-chloro-2-[(5-chloro-2-fluorophenyl)methoxy]phenyl]methanol
SMILESOCc1cccc(Cl)c1OCc1cc(Cl)ccc1F
InChIInChI=1S/C14H11Cl2FO2/c15-11-4-5-13(17)10(6-11)8-19-14-9(7-18)2-1-3-12(14)16/h1-6,18H,7-8H2
InChIKeyAJGCRDVOYBAZNI-UHFFFAOYSA-N
MW301.14 g/mol
LogP4.20
Rot. Bonds4

About [3-chloro-2-[(5-chloro-2-fluorophenyl)methoxy]phenyl]methanol

[3-chloro-2-[(5-chloro-2-fluorophenyl)methoxy]phenyl]methanol (PubChem CID 103046982) has the molecular formula C14H11Cl2FO2 and a molecular weight of 301.14 g/mol. Its IUPAC name is [3-chloro-2-[(5-chloro-2-fluorophenyl)methoxy]phenyl]methanol.

Molecular Properties

Compound Name[3-chloro-2-[(5-chloro-2-fluorophenyl)methoxy]phenyl]methanol
PubChem CID103046982
Molecular FormulaC14H11Cl2FO2
Molecular Weight301.14 g/mol
Exact Mass300.01
IUPAC Name[3-chloro-2-[(5-chloro-2-fluorophenyl)methoxy]phenyl]methanol
SMILESOCc1cccc(Cl)c1OCc1cc(Cl)ccc1F
InChIInChI=1S/C14H11Cl2FO2/c15-11-4-5-13(17)10(6-11)8-19-14-9(7-18)2-1-3-12(14)16/h1-6,18H,7-8H2
InChIKeyAJGCRDVOYBAZNI-UHFFFAOYSA-N
XLogP4.20
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.14
LogP ≤ 54.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-chloro-2-[(5-chloro-2-fluorophenyl)methoxy]-3-(chloromethyl)benzene
CID 103047074
[3,5-dichloro-2-[(5-chloro-2-fluorophenyl)methoxy]phenyl]methanol
CID 103046936
[2-[(2,5-dichlorophenyl)methoxy]-3-fluorophenyl]methanol
CID 112612937
[3-chloro-2-[(3,4-difluorophenyl)methoxy]phenyl]methanol
CID 112612722
[2-[(5-chloro-2-fluorophenyl)methoxy]-3-ethoxyphenyl]methanol
CID 103046926
[3-chloro-2-[(2-chloro-6-fluorophenyl)methoxy]phenyl]methanol
CID 112612622
[2-[(2-chlorophenyl)methoxy]-3-fluorophenyl]methanol
CID 112613091
[3-chloro-2-[(4-fluorophenyl)methoxy]phenyl]methanol
CID 115956286
[2-[(5-bromo-2-fluorophenyl)methoxy]-3-chlorophenyl]methanamine
CID 112607692
[3-chloro-2-[(2-methoxyphenyl)methoxy]phenyl]methanol
CID 112612839
[3-chloro-2-[(3,5-dimethylphenyl)methoxy]phenyl]methanol
CID 112612639
[3-chloro-2-[(2,4,6-trimethylphenyl)methoxy]phenyl]methanol
CID 115956314

Frequently Asked Questions

What is the IUPAC name of [3-chloro-2-[(5-chloro-2-fluorophenyl)methoxy]phenyl]methanol?
The IUPAC name of [3-chloro-2-[(5-chloro-2-fluorophenyl)methoxy]phenyl]methanol (CID 103046982) is [3-chloro-2-[(5-chloro-2-fluorophenyl)methoxy]phenyl]methanol.
What is the SMILES notation for [3-chloro-2-[(5-chloro-2-fluorophenyl)methoxy]phenyl]methanol?
The canonical SMILES for [3-chloro-2-[(5-chloro-2-fluorophenyl)methoxy]phenyl]methanol is OCc1cccc(Cl)c1OCc1cc(Cl)ccc1F.
What is the InChIKey of [3-chloro-2-[(5-chloro-2-fluorophenyl)methoxy]phenyl]methanol?
The InChIKey is AJGCRDVOYBAZNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Cl2FO2/c15-11-4-5-13(17)10(6-11)8-19-14-9(7-18)2-1-3-12(14)16/h1-6,18H,7-8H2.
What are the key properties of [3-chloro-2-[(5-chloro-2-fluorophenyl)methoxy]phenyl]methanol?
[3-chloro-2-[(5-chloro-2-fluorophenyl)methoxy]phenyl]methanol has a molecular weight of 301.14 g/mol, XLogP of 4.20, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-chloro-2-[(5-chloro-2-fluorophenyl)methoxy]phenyl]methanol is sourced from PubChem (CID 103046982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).