(2,6-difluorophenyl)-(2-methoxy-3,4-dimethylphenyl)methanol

C16H16F2O2 — CID 103432506

IUPAC(2,6-difluorophenyl)-(2-methoxy-3,4-dimethylphenyl)methanol
SMILESCOc1c(C(O)c2c(F)cccc2F)ccc(C)c1C
InChIInChI=1S/C16H16F2O2/c1-9-7-8-11(16(20-3)10(9)2)15(19)14-12(17)5-4-6-13(14)18/h4-8,15,19H,1-3H3
InChIKeyKRVIRMWAWSDOHS-UHFFFAOYSA-N
MW278.30 g/mol
LogP3.67
Rot. Bonds3

About (2,6-difluorophenyl)-(2-methoxy-3,4-dimethylphenyl)methanol

(2,6-difluorophenyl)-(2-methoxy-3,4-dimethylphenyl)methanol (PubChem CID 103432506) has the molecular formula C16H16F2O2 and a molecular weight of 278.30 g/mol. Its IUPAC name is (2,6-difluorophenyl)-(2-methoxy-3,4-dimethylphenyl)methanol.

Molecular Properties

Compound Name(2,6-difluorophenyl)-(2-methoxy-3,4-dimethylphenyl)methanol
PubChem CID103432506
Molecular FormulaC16H16F2O2
Molecular Weight278.30 g/mol
Exact Mass278.11
IUPAC Name(2,6-difluorophenyl)-(2-methoxy-3,4-dimethylphenyl)methanol
SMILESCOc1c(C(O)c2c(F)cccc2F)ccc(C)c1C
InChIInChI=1S/C16H16F2O2/c1-9-7-8-11(16(20-3)10(9)2)15(19)14-12(17)5-4-6-13(14)18/h4-8,15,19H,1-3H3
InChIKeyKRVIRMWAWSDOHS-UHFFFAOYSA-N
XLogP3.67
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.30
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2-fluoro-3-methylphenyl)-(2-methoxy-3,4-dimethylphenyl)methanol
CID 103435754
(2-methoxy-3,4-dimethylphenyl)-(2,4,6-trimethylphenyl)methanol
CID 103432508
[3-(difluoromethyl)phenyl]-(2-methoxy-3,4-dimethylphenyl)methanol
CID 103432669
(2,6-difluorophenyl)-(4,5-dimethoxy-2-methylphenyl)methanol
CID 61081893
(3-fluoro-5-methylphenyl)-(2-methoxy-3,4-dimethylphenyl)methanol
CID 103433209
(2-methoxy-3,4-dimethylphenyl)-(3-methoxy-4-methylphenyl)methanol
CID 103435788
(2-methoxy-3,4-dimethylphenyl)-(3-methyl-2-pyridinyl)methanol
CID 103433103
(2,6-difluoro-4-methoxyphenyl)-(2,3-dimethylphenyl)methanol
CID 61099270
(3-chloro-2-pyridinyl)-(2-methoxy-3,4-dimethylphenyl)methanol
CID 103443462
(3,5-dibromophenyl)-(2-methoxy-3,4-dimethylphenyl)methanol
CID 107978788
(2-amino-4-chlorophenyl)-(2-methoxy-3,4-dimethylphenyl)methanol
CID 103433130
(2,6-difluoro-3-methylphenyl)-(2,6-difluorophenyl)methanol
CID 82820156

Frequently Asked Questions

What is the IUPAC name of (2,6-difluorophenyl)-(2-methoxy-3,4-dimethylphenyl)methanol?
The IUPAC name of (2,6-difluorophenyl)-(2-methoxy-3,4-dimethylphenyl)methanol (CID 103432506) is (2,6-difluorophenyl)-(2-methoxy-3,4-dimethylphenyl)methanol.
What is the SMILES notation for (2,6-difluorophenyl)-(2-methoxy-3,4-dimethylphenyl)methanol?
The canonical SMILES for (2,6-difluorophenyl)-(2-methoxy-3,4-dimethylphenyl)methanol is COc1c(C(O)c2c(F)cccc2F)ccc(C)c1C.
What is the InChIKey of (2,6-difluorophenyl)-(2-methoxy-3,4-dimethylphenyl)methanol?
The InChIKey is KRVIRMWAWSDOHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16F2O2/c1-9-7-8-11(16(20-3)10(9)2)15(19)14-12(17)5-4-6-13(14)18/h4-8,15,19H,1-3H3.
What are the key properties of (2,6-difluorophenyl)-(2-methoxy-3,4-dimethylphenyl)methanol?
(2,6-difluorophenyl)-(2-methoxy-3,4-dimethylphenyl)methanol has a molecular weight of 278.30 g/mol, XLogP of 3.67, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2,6-difluorophenyl)-(2-methoxy-3,4-dimethylphenyl)methanol is sourced from PubChem (CID 103432506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).