(4-chlorophenyl)-[2-(2-phenyloxolan-2-yl)phenyl]methanol

C23H21ClO2 — CID 102600362

IUPAC(4-chlorophenyl)-[2-(2-phenyloxolan-2-yl)phenyl]methanol
SMILESOC(c1ccc(Cl)cc1)c1ccccc1C1(c2ccccc2)CCCO1
InChIInChI=1S/C23H21ClO2/c24-19-13-11-17(12-14-19)22(25)20-9-4-5-10-21(20)23(15-6-16-26-23)18-7-2-1-3-8-18/h1-5,7-14,22,25H,6,15-16H2
InChIKeyHKIHYXMPLVCHET-UHFFFAOYSA-N
MW364.87 g/mol
LogP5.48
Rot. Bonds4

About (4-chlorophenyl)-[2-(2-phenyloxolan-2-yl)phenyl]methanol

(4-chlorophenyl)-[2-(2-phenyloxolan-2-yl)phenyl]methanol (PubChem CID 102600362) has the molecular formula C23H21ClO2 and a molecular weight of 364.87 g/mol. Its IUPAC name is (4-chlorophenyl)-[2-(2-phenyloxolan-2-yl)phenyl]methanol.

Molecular Properties

Compound Name(4-chlorophenyl)-[2-(2-phenyloxolan-2-yl)phenyl]methanol
PubChem CID102600362
Molecular FormulaC23H21ClO2
Molecular Weight364.87 g/mol
Exact Mass364.12
IUPAC Name(4-chlorophenyl)-[2-(2-phenyloxolan-2-yl)phenyl]methanol
SMILESOC(c1ccc(Cl)cc1)c1ccccc1C1(c2ccccc2)CCCO1
InChIInChI=1S/C23H21ClO2/c24-19-13-11-17(12-14-19)22(25)20-9-4-5-10-21(20)23(15-6-16-26-23)18-7-2-1-3-8-18/h1-5,7-14,22,25H,6,15-16H2
InChIKeyHKIHYXMPLVCHET-UHFFFAOYSA-N
XLogP5.48
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500364.87
LogP ≤ 55.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4-chlorophenyl)-[2-(2-phenyloxolan-2-yl)phenyl]methanol?
The IUPAC name of (4-chlorophenyl)-[2-(2-phenyloxolan-2-yl)phenyl]methanol (CID 102600362) is (4-chlorophenyl)-[2-(2-phenyloxolan-2-yl)phenyl]methanol.
What is the SMILES notation for (4-chlorophenyl)-[2-(2-phenyloxolan-2-yl)phenyl]methanol?
The canonical SMILES for (4-chlorophenyl)-[2-(2-phenyloxolan-2-yl)phenyl]methanol is OC(c1ccc(Cl)cc1)c1ccccc1C1(c2ccccc2)CCCO1.
What is the InChIKey of (4-chlorophenyl)-[2-(2-phenyloxolan-2-yl)phenyl]methanol?
The InChIKey is HKIHYXMPLVCHET-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21ClO2/c24-19-13-11-17(12-14-19)22(25)20-9-4-5-10-21(20)23(15-6-16-26-23)18-7-2-1-3-8-18/h1-5,7-14,22,25H,6,15-16H2.
What are the key properties of (4-chlorophenyl)-[2-(2-phenyloxolan-2-yl)phenyl]methanol?
(4-chlorophenyl)-[2-(2-phenyloxolan-2-yl)phenyl]methanol has a molecular weight of 364.87 g/mol, XLogP of 5.48, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-chlorophenyl)-[2-(2-phenyloxolan-2-yl)phenyl]methanol is sourced from PubChem (CID 102600362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).