6-chloro-2-[(4-fluorophenoxy)methyl]-1-benzofuran

C15H10ClFO2 — CID 117179379

IUPAC6-chloro-2-[(4-fluorophenoxy)methyl]-1-benzofuran
SMILESFc1ccc(OCc2cc3ccc(Cl)cc3o2)cc1
InChIInChI=1S/C15H10ClFO2/c16-11-2-1-10-7-14(19-15(10)8-11)9-18-13-5-3-12(17)4-6-13/h1-8H,9H2
InChIKeyBCODRLXPCRYGCE-UHFFFAOYSA-N
MW276.69 g/mol
LogP4.80
Rot. Bonds3

About 6-chloro-2-[(4-fluorophenoxy)methyl]-1-benzofuran

6-chloro-2-[(4-fluorophenoxy)methyl]-1-benzofuran (PubChem CID 117179379) has the molecular formula C15H10ClFO2 and a molecular weight of 276.69 g/mol. Its IUPAC name is 6-chloro-2-[(4-fluorophenoxy)methyl]-1-benzofuran.

Molecular Properties

Compound Name6-chloro-2-[(4-fluorophenoxy)methyl]-1-benzofuran
PubChem CID117179379
Molecular FormulaC15H10ClFO2
Molecular Weight276.69 g/mol
Exact Mass276.04
IUPAC Name6-chloro-2-[(4-fluorophenoxy)methyl]-1-benzofuran
SMILESFc1ccc(OCc2cc3ccc(Cl)cc3o2)cc1
InChIInChI=1S/C15H10ClFO2/c16-11-2-1-10-7-14(19-15(10)8-11)9-18-13-5-3-12(17)4-6-13/h1-8H,9H2
InChIKeyBCODRLXPCRYGCE-UHFFFAOYSA-N
XLogP4.80
TPSA22.37 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.69
LogP ≤ 54.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

6-chloro-2-(phenoxymethyl)-1-benzofuran
CID 117179310
6-chloro-2-[(3-chlorophenoxy)methyl]-1-benzofuran
CID 117179353
2-[(4-chlorophenoxy)methyl]-1-benzofuran-6-ol
CID 117179375
6-chloro-2-[(2-methoxyphenoxy)methyl]-1-benzofuran
CID 117179334
2-[(4-methoxyphenoxy)methyl]-6-methyl-1-benzofuran
CID 117185820
2-[(4-fluorophenoxy)methyl]-4-methyl-1-benzofuran
CID 117184713
1-benzofuran-2-ylmethyl 2-(4-fluorophenoxy)acetate
CID 134026431
3-[(5-chloro-1-benzofuran-2-yl)methoxy]pyridine
CID 117175979
3-(2,4-dichlorophenyl)-5-[5-[(4-fluorophenoxy)methyl]furan-2-yl]-1,2,4-oxadiazole
CID 19326495
5-chloro-2-[(3-methylphenoxy)methyl]-1-benzofuran
CID 117175928
2-[(4-methoxyphenoxy)methyl]-1-benzofuran-6-carboxylic acid
CID 117179469
2-(6-chloro-1-benzofuran-2-yl)acetic acid
CID 82612573

Frequently Asked Questions

What is the IUPAC name of 6-chloro-2-[(4-fluorophenoxy)methyl]-1-benzofuran?
The IUPAC name of 6-chloro-2-[(4-fluorophenoxy)methyl]-1-benzofuran (CID 117179379) is 6-chloro-2-[(4-fluorophenoxy)methyl]-1-benzofuran.
What is the SMILES notation for 6-chloro-2-[(4-fluorophenoxy)methyl]-1-benzofuran?
The canonical SMILES for 6-chloro-2-[(4-fluorophenoxy)methyl]-1-benzofuran is Fc1ccc(OCc2cc3ccc(Cl)cc3o2)cc1.
What is the InChIKey of 6-chloro-2-[(4-fluorophenoxy)methyl]-1-benzofuran?
The InChIKey is BCODRLXPCRYGCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10ClFO2/c16-11-2-1-10-7-14(19-15(10)8-11)9-18-13-5-3-12(17)4-6-13/h1-8H,9H2.
What are the key properties of 6-chloro-2-[(4-fluorophenoxy)methyl]-1-benzofuran?
6-chloro-2-[(4-fluorophenoxy)methyl]-1-benzofuran has a molecular weight of 276.69 g/mol, XLogP of 4.80, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-2-[(4-fluorophenoxy)methyl]-1-benzofuran is sourced from PubChem (CID 117179379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).