[3,5-dichloro-2-[(2,4-difluorophenyl)methoxy]phenyl]methanol

C14H10Cl2F2O2 — CID 62196694

IUPAC[3,5-dichloro-2-[(2,4-difluorophenyl)methoxy]phenyl]methanol
SMILESOCc1cc(Cl)cc(Cl)c1OCc1ccc(F)cc1F
InChIInChI=1S/C14H10Cl2F2O2/c15-10-3-9(6-19)14(12(16)4-10)20-7-8-1-2-11(17)5-13(8)18/h1-5,19H,6-7H2
InChIKeyPTYCASCVLPBUNI-UHFFFAOYSA-N
MW319.13 g/mol
LogP4.34
Rot. Bonds4

About [3,5-dichloro-2-[(2,4-difluorophenyl)methoxy]phenyl]methanol

[3,5-dichloro-2-[(2,4-difluorophenyl)methoxy]phenyl]methanol (PubChem CID 62196694) has the molecular formula C14H10Cl2F2O2 and a molecular weight of 319.13 g/mol. Its IUPAC name is [3,5-dichloro-2-[(2,4-difluorophenyl)methoxy]phenyl]methanol.

Molecular Properties

Compound Name[3,5-dichloro-2-[(2,4-difluorophenyl)methoxy]phenyl]methanol
PubChem CID62196694
Molecular FormulaC14H10Cl2F2O2
Molecular Weight319.13 g/mol
Exact Mass318.00
IUPAC Name[3,5-dichloro-2-[(2,4-difluorophenyl)methoxy]phenyl]methanol
SMILESOCc1cc(Cl)cc(Cl)c1OCc1ccc(F)cc1F
InChIInChI=1S/C14H10Cl2F2O2/c15-10-3-9(6-19)14(12(16)4-10)20-7-8-1-2-11(17)5-13(8)18/h1-5,19H,6-7H2
InChIKeyPTYCASCVLPBUNI-UHFFFAOYSA-N
XLogP4.34
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.13
LogP ≤ 54.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[2-[(4-bromo-2-fluorophenyl)methoxy]-3,5-dichlorophenyl]methanol
CID 43516255
[3,5-dichloro-2-[(5-chloro-2-fluorophenyl)methoxy]phenyl]methanol
CID 103046936
[3,5-dichloro-2-[(5-chloro-2-methoxyphenyl)methoxy]phenyl]methanol
CID 43646746
[2-[(2-chloro-5-fluorophenyl)methoxy]-5-fluoro-3-(hydroxymethyl)phenyl]methanol
CID 99823533
[3-chloro-2-[(5-chloro-2-fluorophenyl)methoxy]phenyl]methanol
CID 103046982
2-[3,5-dichloro-2-[(5-chloro-2-fluorophenyl)methoxy]phenyl]ethanamine
CID 103049271
[3,5-dichloro-2-[(4-methoxyphenyl)methoxy]phenyl]methanol
CID 43516151
[2-[(2-bromo-5-methoxyphenyl)methoxy]-3,5-dichlorophenyl]methanol
CID 65322928
[2-[(2,6-dichlorophenyl)methoxy]-5-fluoro-3-(hydroxymethyl)phenyl]methanol
CID 112788149
2-[(2-bromo-4-fluorophenyl)methoxy]-3,5-dichlorobenzoic acid
CID 43516140
[2-[(2,5-dichlorophenyl)methoxy]-3-fluorophenyl]methanol
CID 112612937
[3-chloro-4-[(4-chloro-2-fluorophenyl)methoxy]phenyl]methanol
CID 114850107

Frequently Asked Questions

What is the IUPAC name of [3,5-dichloro-2-[(2,4-difluorophenyl)methoxy]phenyl]methanol?
The IUPAC name of [3,5-dichloro-2-[(2,4-difluorophenyl)methoxy]phenyl]methanol (CID 62196694) is [3,5-dichloro-2-[(2,4-difluorophenyl)methoxy]phenyl]methanol.
What is the SMILES notation for [3,5-dichloro-2-[(2,4-difluorophenyl)methoxy]phenyl]methanol?
The canonical SMILES for [3,5-dichloro-2-[(2,4-difluorophenyl)methoxy]phenyl]methanol is OCc1cc(Cl)cc(Cl)c1OCc1ccc(F)cc1F.
What is the InChIKey of [3,5-dichloro-2-[(2,4-difluorophenyl)methoxy]phenyl]methanol?
The InChIKey is PTYCASCVLPBUNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Cl2F2O2/c15-10-3-9(6-19)14(12(16)4-10)20-7-8-1-2-11(17)5-13(8)18/h1-5,19H,6-7H2.
What are the key properties of [3,5-dichloro-2-[(2,4-difluorophenyl)methoxy]phenyl]methanol?
[3,5-dichloro-2-[(2,4-difluorophenyl)methoxy]phenyl]methanol has a molecular weight of 319.13 g/mol, XLogP of 4.34, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3,5-dichloro-2-[(2,4-difluorophenyl)methoxy]phenyl]methanol is sourced from PubChem (CID 62196694), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).