2-[1-(2-chlorophenyl)ethyl]furan

C12H11ClO — CID 21387745

IUPAC2-[1-(2-chlorophenyl)ethyl]furan
SMILESCC(c1ccco1)c1ccccc1Cl
InChIInChI=1S/C12H11ClO/c1-9(12-7-4-8-14-12)10-5-2-3-6-11(10)13/h2-9H,1H3
InChIKeyIVQOSDGQTJNKCN-UHFFFAOYSA-N
MW206.67 g/mol
LogP4.08
Rot. Bonds2

About 2-[1-(2-chlorophenyl)ethyl]furan

2-[1-(2-chlorophenyl)ethyl]furan (PubChem CID 21387745) has the molecular formula C12H11ClO and a molecular weight of 206.67 g/mol. Its IUPAC name is 2-[1-(2-chlorophenyl)ethyl]furan.

Molecular Properties

Compound Name2-[1-(2-chlorophenyl)ethyl]furan
PubChem CID21387745
Molecular FormulaC12H11ClO
Molecular Weight206.67 g/mol
Exact Mass206.05
IUPAC Name2-[1-(2-chlorophenyl)ethyl]furan
SMILESCC(c1ccco1)c1ccccc1Cl
InChIInChI=1S/C12H11ClO/c1-9(12-7-4-8-14-12)10-5-2-3-6-11(10)13/h2-9H,1H3
InChIKeyIVQOSDGQTJNKCN-UHFFFAOYSA-N
XLogP4.08
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.67
LogP ≤ 54.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-[1-(4-chlorophenyl)ethyl]furan
CID 21387728
(3-chloro-2-methylphenyl)-(furan-2-yl)methanamine
CID 107096502
[(3-chloro-2-methylphenyl)-(furan-2-yl)methyl]hydrazine
CID 107103681
2-chloro-N-[1-(furan-2-yl)ethyl]benzamide
CID 18116836
1-(2-chlorophenyl)ethylazanium chloride
CID 160644474
2-propan-2-ylaniline;2-propan-2-ylfuran
CID 158742039
1-chloro-2-(1-nitroethyl)benzene
CID 21252639
(2S)-2-(2-chlorophenyl)-1-(furan-2-yl)-2-hydroxyethanone
CID 125483361
(2R)-2-(2-chlorophenyl)-1-(furan-2-yl)-2-hydroxyethanone
CID 125483360
2-[[(2-chlorophenyl)-(4-fluorophenyl)methyl]amino]-N-[1-(furan-2-yl)ethyl]acetamide
CID 87029637
(1S)-1-(2-chlorophenyl)-N-methylethanamine
CID 30073865
(1S,2R)-1-(2-chlorophenyl)propane-1,2-diol
CID 66634039

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-chlorophenyl)ethyl]furan?
The IUPAC name of 2-[1-(2-chlorophenyl)ethyl]furan (CID 21387745) is 2-[1-(2-chlorophenyl)ethyl]furan.
What is the SMILES notation for 2-[1-(2-chlorophenyl)ethyl]furan?
The canonical SMILES for 2-[1-(2-chlorophenyl)ethyl]furan is CC(c1ccco1)c1ccccc1Cl.
What is the InChIKey of 2-[1-(2-chlorophenyl)ethyl]furan?
The InChIKey is IVQOSDGQTJNKCN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11ClO/c1-9(12-7-4-8-14-12)10-5-2-3-6-11(10)13/h2-9H,1H3.
What are the key properties of 2-[1-(2-chlorophenyl)ethyl]furan?
2-[1-(2-chlorophenyl)ethyl]furan has a molecular weight of 206.67 g/mol, XLogP of 4.08, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-chlorophenyl)ethyl]furan is sourced from PubChem (CID 21387745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).