(2,5-difluorophenyl)-(3,5-dimethoxyphenyl)methanol

C15H14F2O3 — CID 61100108

IUPAC(2,5-difluorophenyl)-(3,5-dimethoxyphenyl)methanol
SMILESCOc1cc(OC)cc(C(O)c2cc(F)ccc2F)c1
InChIInChI=1S/C15H14F2O3/c1-19-11-5-9(6-12(8-11)20-2)15(18)13-7-10(16)3-4-14(13)17/h3-8,15,18H,1-2H3
InChIKeyPACAOMDCOMYWBV-UHFFFAOYSA-N
MW280.27 g/mol
LogP3.06
Rot. Bonds4

About (2,5-difluorophenyl)-(3,5-dimethoxyphenyl)methanol

(2,5-difluorophenyl)-(3,5-dimethoxyphenyl)methanol (PubChem CID 61100108) has the molecular formula C15H14F2O3 and a molecular weight of 280.27 g/mol. Its IUPAC name is (2,5-difluorophenyl)-(3,5-dimethoxyphenyl)methanol.

Molecular Properties

Compound Name(2,5-difluorophenyl)-(3,5-dimethoxyphenyl)methanol
PubChem CID61100108
Molecular FormulaC15H14F2O3
Molecular Weight280.27 g/mol
Exact Mass280.09
IUPAC Name(2,5-difluorophenyl)-(3,5-dimethoxyphenyl)methanol
SMILESCOc1cc(OC)cc(C(O)c2cc(F)ccc2F)c1
InChIInChI=1S/C15H14F2O3/c1-19-11-5-9(6-12(8-11)20-2)15(18)13-7-10(16)3-4-14(13)17/h3-8,15,18H,1-2H3
InChIKeyPACAOMDCOMYWBV-UHFFFAOYSA-N
XLogP3.06
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.27
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3,5-dimethoxyphenyl)-(2,4,5-trifluorophenyl)methanol
CID 103303239
1-(2,5-difluorophenyl)-2-(3,5-dimethoxyphenoxy)ethanol
CID 109415013
(2,5-difluorophenyl)-(2-methoxyphenyl)methanol
CID 61100106
(2,5-difluorophenyl)-(3-propan-2-yloxyphenyl)methanol
CID 62918976
(2,5-difluorophenyl)-(4-fluoro-3-methylphenyl)methanol
CID 62802735
(4-chloro-2-methoxyphenyl)-(3,5-dimethoxyphenyl)methanol
CID 115821652
(3-bromo-5-fluorophenyl)-(2,5-difluorophenyl)methanol
CID 61101647
(5-chloro-2-fluorophenyl)-(5-fluoro-2-methoxyphenyl)methanol
CID 61087442
2-(2,4-difluorophenyl)-1-(3,5-dimethoxyphenyl)ethanol
CID 63894517
(2,5-difluorophenyl)-[3-(trifluoromethoxy)phenyl]methanol
CID 63661812
(3,5-difluorophenyl)-(2-fluoro-4-methoxyphenyl)methanol
CID 61083265
(3,5-dimethoxyphenyl)-(5-fluoro-2-methoxyphenyl)methanamine
CID 43122354

Frequently Asked Questions

What is the IUPAC name of (2,5-difluorophenyl)-(3,5-dimethoxyphenyl)methanol?
The IUPAC name of (2,5-difluorophenyl)-(3,5-dimethoxyphenyl)methanol (CID 61100108) is (2,5-difluorophenyl)-(3,5-dimethoxyphenyl)methanol.
What is the SMILES notation for (2,5-difluorophenyl)-(3,5-dimethoxyphenyl)methanol?
The canonical SMILES for (2,5-difluorophenyl)-(3,5-dimethoxyphenyl)methanol is COc1cc(OC)cc(C(O)c2cc(F)ccc2F)c1.
What is the InChIKey of (2,5-difluorophenyl)-(3,5-dimethoxyphenyl)methanol?
The InChIKey is PACAOMDCOMYWBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14F2O3/c1-19-11-5-9(6-12(8-11)20-2)15(18)13-7-10(16)3-4-14(13)17/h3-8,15,18H,1-2H3.
What are the key properties of (2,5-difluorophenyl)-(3,5-dimethoxyphenyl)methanol?
(2,5-difluorophenyl)-(3,5-dimethoxyphenyl)methanol has a molecular weight of 280.27 g/mol, XLogP of 3.06, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2,5-difluorophenyl)-(3,5-dimethoxyphenyl)methanol is sourced from PubChem (CID 61100108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).