(R)-dibenzofuran-3-yl-(2,4-dichlorophenyl)methanol

C19H12Cl2O2 — CID 100804352

IUPAC(R)-dibenzofuran-3-yl-(2,4-dichlorophenyl)methanol
SMILESO[C@H](c1ccc2c(c1)oc1ccccc12)c1ccc(Cl)cc1Cl
InChIInChI=1S/C19H12Cl2O2/c20-12-6-8-15(16(21)10-12)19(22)11-5-7-14-13-3-1-2-4-17(13)23-18(14)9-11/h1-10,19,22H/t19-/m1/s1
InChIKeyODWWCTQTTOUQHS-LJQANCHMSA-N
MW343.21 g/mol
LogP5.97
Rot. Bonds2

About (R)-dibenzofuran-3-yl-(2,4-dichlorophenyl)methanol

(R)-dibenzofuran-3-yl-(2,4-dichlorophenyl)methanol (PubChem CID 100804352) has the molecular formula C19H12Cl2O2 and a molecular weight of 343.21 g/mol. Its IUPAC name is (R)-dibenzofuran-3-yl-(2,4-dichlorophenyl)methanol.

Molecular Properties

Compound Name(R)-dibenzofuran-3-yl-(2,4-dichlorophenyl)methanol
PubChem CID100804352
Molecular FormulaC19H12Cl2O2
Molecular Weight343.21 g/mol
Exact Mass342.02
IUPAC Name(R)-dibenzofuran-3-yl-(2,4-dichlorophenyl)methanol
SMILESO[C@H](c1ccc2c(c1)oc1ccccc12)c1ccc(Cl)cc1Cl
InChIInChI=1S/C19H12Cl2O2/c20-12-6-8-15(16(21)10-12)19(22)11-5-7-14-13-3-1-2-4-17(13)23-18(14)9-11/h1-10,19,22H/t19-/m1/s1
InChIKeyODWWCTQTTOUQHS-LJQANCHMSA-N
XLogP5.97
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500343.21
LogP ≤ 55.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (R)-dibenzofuran-3-yl-(2,4-dichlorophenyl)methanol?
The IUPAC name of (R)-dibenzofuran-3-yl-(2,4-dichlorophenyl)methanol (CID 100804352) is (R)-dibenzofuran-3-yl-(2,4-dichlorophenyl)methanol.
What is the SMILES notation for (R)-dibenzofuran-3-yl-(2,4-dichlorophenyl)methanol?
The canonical SMILES for (R)-dibenzofuran-3-yl-(2,4-dichlorophenyl)methanol is O[C@H](c1ccc2c(c1)oc1ccccc12)c1ccc(Cl)cc1Cl.
What is the InChIKey of (R)-dibenzofuran-3-yl-(2,4-dichlorophenyl)methanol?
The InChIKey is ODWWCTQTTOUQHS-LJQANCHMSA-N. The full InChI is InChI=1S/C19H12Cl2O2/c20-12-6-8-15(16(21)10-12)19(22)11-5-7-14-13-3-1-2-4-17(13)23-18(14)9-11/h1-10,19,22H/t19-/m1/s1.
What are the key properties of (R)-dibenzofuran-3-yl-(2,4-dichlorophenyl)methanol?
(R)-dibenzofuran-3-yl-(2,4-dichlorophenyl)methanol has a molecular weight of 343.21 g/mol, XLogP of 5.97, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (R)-dibenzofuran-3-yl-(2,4-dichlorophenyl)methanol is sourced from PubChem (CID 100804352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).