2-(3-chlorophenyl)-1-(2,3-dihydro-1-benzofuran-5-yl)ethanol

C16H15ClO2 — CID 62505676

IUPAC2-(3-chlorophenyl)-1-(2,3-dihydro-1-benzofuran-5-yl)ethanol
SMILESOC(Cc1cccc(Cl)c1)c1ccc2c(c1)CCO2
InChIInChI=1S/C16H15ClO2/c17-14-3-1-2-11(8-14)9-15(18)12-4-5-16-13(10-12)6-7-19-16/h1-5,8,10,15,18H,6-7,9H2
InChIKeyYAIQCDFVKVDTNH-UHFFFAOYSA-N
MW274.75 g/mol
LogP3.55
Rot. Bonds3

About 2-(3-chlorophenyl)-1-(2,3-dihydro-1-benzofuran-5-yl)ethanol

2-(3-chlorophenyl)-1-(2,3-dihydro-1-benzofuran-5-yl)ethanol (PubChem CID 62505676) has the molecular formula C16H15ClO2 and a molecular weight of 274.75 g/mol. Its IUPAC name is 2-(3-chlorophenyl)-1-(2,3-dihydro-1-benzofuran-5-yl)ethanol.

Molecular Properties

Compound Name2-(3-chlorophenyl)-1-(2,3-dihydro-1-benzofuran-5-yl)ethanol
PubChem CID62505676
Molecular FormulaC16H15ClO2
Molecular Weight274.75 g/mol
Exact Mass274.08
IUPAC Name2-(3-chlorophenyl)-1-(2,3-dihydro-1-benzofuran-5-yl)ethanol
SMILESOC(Cc1cccc(Cl)c1)c1ccc2c(c1)CCO2
InChIInChI=1S/C16H15ClO2/c17-14-3-1-2-11(8-14)9-15(18)12-4-5-16-13(10-12)6-7-19-16/h1-5,8,10,15,18H,6-7,9H2
InChIKeyYAIQCDFVKVDTNH-UHFFFAOYSA-N
XLogP3.55
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.75
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2,3-dichlorophenyl)-1-(2,3-dihydro-1-benzofuran-5-yl)ethanol
CID 107307473
2-(5-chloro-2-fluorophenyl)-1-(2,3-dihydro-1-benzofuran-5-yl)ethanol
CID 103047606
3-chloro-N-[2-(2,3-dihydro-1-benzofuran-5-yl)-2-hydroxyethyl]benzamide
CID 90580722
2-(3-chlorophenyl)-1-(2,3-dihydro-1H-inden-5-yl)ethanol
CID 62503763
2-(4-chlorophenyl)-1-(3,4-dihydro-2H-chromen-6-yl)ethanol
CID 61080781
2-(3-chlorophenyl)-1-(2,3-dihydro-1-benzofuran-7-yl)ethanol
CID 114744440
1-(2,3-dihydro-1-benzofuran-5-yl)-2-(furan-2-yl)ethanol
CID 83171228
1-(2,3-dihydro-1-benzofuran-5-yl)-2-(2-methylphenyl)ethanol
CID 61100428
1-(2,3-dihydro-1-benzofuran-5-yl)-3-(3-methylphenyl)propan-1-ol
CID 105125289
5-[1-chloro-2-(3-fluorophenyl)ethyl]-2,3-dihydro-1-benzofuran
CID 61086151
1-(2,3-dihydro-1-benzofuran-5-yl)butan-1-ol
CID 61100081
(3,5-dichlorophenyl)-(2,3-dihydro-1-benzofuran-5-yl)methanol
CID 61100429

Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenyl)-1-(2,3-dihydro-1-benzofuran-5-yl)ethanol?
The IUPAC name of 2-(3-chlorophenyl)-1-(2,3-dihydro-1-benzofuran-5-yl)ethanol (CID 62505676) is 2-(3-chlorophenyl)-1-(2,3-dihydro-1-benzofuran-5-yl)ethanol.
What is the SMILES notation for 2-(3-chlorophenyl)-1-(2,3-dihydro-1-benzofuran-5-yl)ethanol?
The canonical SMILES for 2-(3-chlorophenyl)-1-(2,3-dihydro-1-benzofuran-5-yl)ethanol is OC(Cc1cccc(Cl)c1)c1ccc2c(c1)CCO2.
What is the InChIKey of 2-(3-chlorophenyl)-1-(2,3-dihydro-1-benzofuran-5-yl)ethanol?
The InChIKey is YAIQCDFVKVDTNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15ClO2/c17-14-3-1-2-11(8-14)9-15(18)12-4-5-16-13(10-12)6-7-19-16/h1-5,8,10,15,18H,6-7,9H2.
What are the key properties of 2-(3-chlorophenyl)-1-(2,3-dihydro-1-benzofuran-5-yl)ethanol?
2-(3-chlorophenyl)-1-(2,3-dihydro-1-benzofuran-5-yl)ethanol has a molecular weight of 274.75 g/mol, XLogP of 3.55, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenyl)-1-(2,3-dihydro-1-benzofuran-5-yl)ethanol is sourced from PubChem (CID 62505676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).