(2,4-difluorophenyl)-(5-methylfuran-3-yl)methanol

C12H10F2O2 — CID 114822277

IUPAC(2,4-difluorophenyl)-(5-methylfuran-3-yl)methanol
SMILESCc1cc(C(O)c2ccc(F)cc2F)co1
InChIInChI=1S/C12H10F2O2/c1-7-4-8(6-16-7)12(15)10-3-2-9(13)5-11(10)14/h2-6,12,15H,1H3
InChIKeyMUHUGLSZSYVMOC-UHFFFAOYSA-N
MW224.21 g/mol
LogP2.95
Rot. Bonds2

About (2,4-difluorophenyl)-(5-methylfuran-3-yl)methanol

(2,4-difluorophenyl)-(5-methylfuran-3-yl)methanol (PubChem CID 114822277) has the molecular formula C12H10F2O2 and a molecular weight of 224.21 g/mol. Its IUPAC name is (2,4-difluorophenyl)-(5-methylfuran-3-yl)methanol.

Molecular Properties

Compound Name(2,4-difluorophenyl)-(5-methylfuran-3-yl)methanol
PubChem CID114822277
Molecular FormulaC12H10F2O2
Molecular Weight224.21 g/mol
Exact Mass224.06
IUPAC Name(2,4-difluorophenyl)-(5-methylfuran-3-yl)methanol
SMILESCc1cc(C(O)c2ccc(F)cc2F)co1
InChIInChI=1S/C12H10F2O2/c1-7-4-8(6-16-7)12(15)10-3-2-9(13)5-11(10)14/h2-6,12,15H,1H3
InChIKeyMUHUGLSZSYVMOC-UHFFFAOYSA-N
XLogP2.95
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.21
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(3-bromo-4-methylphenyl)-(2,4-difluorophenyl)methanol
CID 81476067
(2,4-difluorophenyl)-(3-methylfuran-2-yl)methanol
CID 61087172
(2,4-difluorophenyl)-naphthalen-2-ylmethanol
CID 61087912
2-(2,5-difluorophenyl)-1-(5-methylfuran-3-yl)ethanol
CID 114982000
(2,4-difluorophenyl)-(2-fluoro-5-methylphenyl)methanol
CID 62510487
(2,4-difluorophenyl)-pyrimidin-5-ylmethanol
CID 63084368
(3-aminophenyl)-(2,4-difluorophenyl)methanol
CID 106695899
(2,4-difluorophenyl)-(5-methylpyrazin-2-yl)methanol
CID 105094711
(2,4-difluorophenyl)-[4-(2-methylpropyl)phenyl]methanol
CID 61100850
(2,4-difluorophenyl)methanediol
CID 91089962
(2-fluoro-4-methylphenyl)-(3-fluorophenyl)methanol
CID 114978479
(4-bromo-2-methylphenyl)-(2,4-difluorophenyl)methanol
CID 61087729

Frequently Asked Questions

What is the IUPAC name of (2,4-difluorophenyl)-(5-methylfuran-3-yl)methanol?
The IUPAC name of (2,4-difluorophenyl)-(5-methylfuran-3-yl)methanol (CID 114822277) is (2,4-difluorophenyl)-(5-methylfuran-3-yl)methanol.
What is the SMILES notation for (2,4-difluorophenyl)-(5-methylfuran-3-yl)methanol?
The canonical SMILES for (2,4-difluorophenyl)-(5-methylfuran-3-yl)methanol is Cc1cc(C(O)c2ccc(F)cc2F)co1.
What is the InChIKey of (2,4-difluorophenyl)-(5-methylfuran-3-yl)methanol?
The InChIKey is MUHUGLSZSYVMOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10F2O2/c1-7-4-8(6-16-7)12(15)10-3-2-9(13)5-11(10)14/h2-6,12,15H,1H3.
What are the key properties of (2,4-difluorophenyl)-(5-methylfuran-3-yl)methanol?
(2,4-difluorophenyl)-(5-methylfuran-3-yl)methanol has a molecular weight of 224.21 g/mol, XLogP of 2.95, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2,4-difluorophenyl)-(5-methylfuran-3-yl)methanol is sourced from PubChem (CID 114822277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).