4-chloro-2-ethyl-1-benzofuran

C10H9ClO — CID 173058646

IUPAC4-chloro-2-ethyl-1-benzofuran
SMILESCCc1cc2c(Cl)cccc2o1
InChIInChI=1S/C10H9ClO/c1-2-7-6-8-9(11)4-3-5-10(8)12-7/h3-6H,2H2,1H3
InChIKeyFZHUPUXWPYKNKA-UHFFFAOYSA-N
MW180.63 g/mol
LogP3.65
Rot. Bonds1

About 4-chloro-2-ethyl-1-benzofuran

4-chloro-2-ethyl-1-benzofuran (PubChem CID 173058646) has the molecular formula C10H9ClO and a molecular weight of 180.63 g/mol. Its IUPAC name is 4-chloro-2-ethyl-1-benzofuran.

Molecular Properties

Compound Name4-chloro-2-ethyl-1-benzofuran
PubChem CID173058646
Molecular FormulaC10H9ClO
Molecular Weight180.63 g/mol
Exact Mass180.03
IUPAC Name4-chloro-2-ethyl-1-benzofuran
SMILESCCc1cc2c(Cl)cccc2o1
InChIInChI=1S/C10H9ClO/c1-2-7-6-8-9(11)4-3-5-10(8)12-7/h3-6H,2H2,1H3
InChIKeyFZHUPUXWPYKNKA-UHFFFAOYSA-N
XLogP3.65
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.63
LogP ≤ 53.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-(4-chloro-1-benzofuran-2-yl)propan-2-one
CID 117194376
3-(4-chloro-1-benzofuran-2-yl)-2-methylpropanoic acid
CID 117119938
4-cyclopropyl-2-ethyl-1-benzofuran
CID 163372341
4-chloro-2-ethylfuro[3,2-c]pyridine
CID 71756241
(4-chloro-1-benzofuran-2-yl)-(4-ethylphenyl)methanone
CID 114321295
2-(4-chloro-1-benzofuran-2-yl)propan-1-amine
CID 117119913
4-chloro-1-benzofuran-2-sulfonyl chloride
CID 83900452
2-(ethylsulfonylmethyl)-4-fluoro-1-benzofuran
CID 117172256
2,6-dichloro-N-[(2-ethyl-1-benzofuran-3-yl)methyl]aniline
CID 65469504
4-chloro-2-isocyanato-1-benzofuran
CID 83818394
(4-chloro-1-benzofuran-2-yl)-(4-chlorophenyl)methanamine
CID 114321372
N-[(4-methyl-1-benzofuran-2-yl)methyl]ethanamine
CID 117184721

Frequently Asked Questions

What is the IUPAC name of 4-chloro-2-ethyl-1-benzofuran?
The IUPAC name of 4-chloro-2-ethyl-1-benzofuran (CID 173058646) is 4-chloro-2-ethyl-1-benzofuran.
What is the SMILES notation for 4-chloro-2-ethyl-1-benzofuran?
The canonical SMILES for 4-chloro-2-ethyl-1-benzofuran is CCc1cc2c(Cl)cccc2o1.
What is the InChIKey of 4-chloro-2-ethyl-1-benzofuran?
The InChIKey is FZHUPUXWPYKNKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9ClO/c1-2-7-6-8-9(11)4-3-5-10(8)12-7/h3-6H,2H2,1H3.
What are the key properties of 4-chloro-2-ethyl-1-benzofuran?
4-chloro-2-ethyl-1-benzofuran has a molecular weight of 180.63 g/mol, XLogP of 3.65, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-2-ethyl-1-benzofuran is sourced from PubChem (CID 173058646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).