5-[(2-chlorophenyl)methyl]-2,3-dihydro-1-benzofuran

C15H13ClO — CID 141276691

IUPAC5-[(2-chlorophenyl)methyl]-2,3-dihydro-1-benzofuran
SMILESClc1ccccc1Cc1ccc2c(c1)CCO2
InChIInChI=1S/C15H13ClO/c16-14-4-2-1-3-12(14)9-11-5-6-15-13(10-11)7-8-17-15/h1-6,10H,7-9H2
InChIKeyBCNBYYYQSAOPAA-UHFFFAOYSA-N
MW244.72 g/mol
LogP3.87
Rot. Bonds2

About 5-[(2-chlorophenyl)methyl]-2,3-dihydro-1-benzofuran

5-[(2-chlorophenyl)methyl]-2,3-dihydro-1-benzofuran (PubChem CID 141276691) has the molecular formula C15H13ClO and a molecular weight of 244.72 g/mol. Its IUPAC name is 5-[(2-chlorophenyl)methyl]-2,3-dihydro-1-benzofuran.

Molecular Properties

Compound Name5-[(2-chlorophenyl)methyl]-2,3-dihydro-1-benzofuran
PubChem CID141276691
Molecular FormulaC15H13ClO
Molecular Weight244.72 g/mol
Exact Mass244.07
IUPAC Name5-[(2-chlorophenyl)methyl]-2,3-dihydro-1-benzofuran
SMILESClc1ccccc1Cc1ccc2c(c1)CCO2
InChIInChI=1S/C15H13ClO/c16-14-4-2-1-3-12(14)9-11-5-6-15-13(10-11)7-8-17-15/h1-6,10H,7-9H2
InChIKeyBCNBYYYQSAOPAA-UHFFFAOYSA-N
XLogP3.87
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.72
LogP ≤ 53.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2-chlorophenyl)-N-[1-(2,3-dihydro-1-benzofuran-5-yl)propan-2-yl]acetamide
CID 91813491
5-[2-(2-chlorophenoxy)ethyl]-2,3-dihydro-1-benzofuran
CID 65441677
5-(chloromethyl)-2,3-dihydro-1-benzofuran
CID 11789614
2-chloro-N-[2-[[2-(2,3-dihydro-1-benzofuran-5-yl)acetyl]amino]ethyl]benzamide
CID 55659427
(3S,4R)-6-[4-chloro-3-(2,3-dihydro-1-benzofuran-5-ylmethyl)phenyl]-2-methylsulfanyloxane-3,4-diol
CID 170242742
5-[2-[2-(bromomethyl)-6-chlorophenoxy]ethyl]-2,3-dihydro-1-benzofuran
CID 115956716
1-(2-chlorophenyl)-N-(2,3-dihydro-1-benzofuran-5-ylmethyl)ethanamine
CID 43804139
N-[(2-chlorophenyl)methyl]-2,3-dihydro-1-benzofuran-5-sulfonamide
CID 51178741
2,3-dichloro-N-(2,3-dihydro-1-benzofuran-5-ylmethyl)aniline
CID 43804211
2,3-dihydro-1-benzofuran-5-ylmethanethiol
CID 79885132
2,3-dihydro-1-benzofuran-5-ylmethylazanium
CID 6932006
(1S)-1-(2-chlorophenyl)-N-[2-(2,3-dihydro-1-benzofuran-5-yl)ethyl]ethanamine
CID 81375305

Frequently Asked Questions

What is the IUPAC name of 5-[(2-chlorophenyl)methyl]-2,3-dihydro-1-benzofuran?
The IUPAC name of 5-[(2-chlorophenyl)methyl]-2,3-dihydro-1-benzofuran (CID 141276691) is 5-[(2-chlorophenyl)methyl]-2,3-dihydro-1-benzofuran.
What is the SMILES notation for 5-[(2-chlorophenyl)methyl]-2,3-dihydro-1-benzofuran?
The canonical SMILES for 5-[(2-chlorophenyl)methyl]-2,3-dihydro-1-benzofuran is Clc1ccccc1Cc1ccc2c(c1)CCO2.
What is the InChIKey of 5-[(2-chlorophenyl)methyl]-2,3-dihydro-1-benzofuran?
The InChIKey is BCNBYYYQSAOPAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClO/c16-14-4-2-1-3-12(14)9-11-5-6-15-13(10-11)7-8-17-15/h1-6,10H,7-9H2.
What are the key properties of 5-[(2-chlorophenyl)methyl]-2,3-dihydro-1-benzofuran?
5-[(2-chlorophenyl)methyl]-2,3-dihydro-1-benzofuran has a molecular weight of 244.72 g/mol, XLogP of 3.87, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[(2-chlorophenyl)methyl]-2,3-dihydro-1-benzofuran is sourced from PubChem (CID 141276691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).