7-(2,4-dichlorophenyl)-5-methoxy-2-methyl-2,3-dihydro-1-benzofuran

C16H14Cl2O2 — CID 69177577

IUPAC7-(2,4-dichlorophenyl)-5-methoxy-2-methyl-2,3-dihydro-1-benzofuran
SMILESCOc1cc2c(c(-c3ccc(Cl)cc3Cl)c1)OC(C)C2
InChIInChI=1S/C16H14Cl2O2/c1-9-5-10-6-12(19-2)8-14(16(10)20-9)13-4-3-11(17)7-15(13)18/h3-4,6-9H,5H2,1-2H3
InChIKeyDNLDFSVLZRLFGA-UHFFFAOYSA-N
MW309.19 g/mol
LogP4.99
Rot. Bonds2

About 7-(2,4-dichlorophenyl)-5-methoxy-2-methyl-2,3-dihydro-1-benzofuran

7-(2,4-dichlorophenyl)-5-methoxy-2-methyl-2,3-dihydro-1-benzofuran (PubChem CID 69177577) has the molecular formula C16H14Cl2O2 and a molecular weight of 309.19 g/mol. Its IUPAC name is 7-(2,4-dichlorophenyl)-5-methoxy-2-methyl-2,3-dihydro-1-benzofuran.

Molecular Properties

Compound Name7-(2,4-dichlorophenyl)-5-methoxy-2-methyl-2,3-dihydro-1-benzofuran
PubChem CID69177577
Molecular FormulaC16H14Cl2O2
Molecular Weight309.19 g/mol
Exact Mass308.04
IUPAC Name7-(2,4-dichlorophenyl)-5-methoxy-2-methyl-2,3-dihydro-1-benzofuran
SMILESCOc1cc2c(c(-c3ccc(Cl)cc3Cl)c1)OC(C)C2
InChIInChI=1S/C16H14Cl2O2/c1-9-5-10-6-12(19-2)8-14(16(10)20-9)13-4-3-11(17)7-15(13)18/h3-4,6-9H,5H2,1-2H3
InChIKeyDNLDFSVLZRLFGA-UHFFFAOYSA-N
XLogP4.99
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.19
LogP ≤ 54.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

7-(2,5-dichlorophenyl)-5-methoxy-2-methyl-2,3-dihydro-1-benzofuran
CID 69107948
5-chloro-7-(2,4-dimethoxyphenyl)-2-methyl-2,3-dihydro-1-benzofuran
CID 69108325
5-chloro-7-(2,3-dimethoxyphenyl)-2-methyl-2,3-dihydro-1-benzofuran
CID 69181308
7-(5-chloro-2-methoxyphenyl)-2-methyl-2,3-dihydro-1-benzofuran
CID 69108156
[7-(2-chlorophenyl)-5-methoxy-2,3-dihydro-1-benzofuran-2-yl]-diethyl-methylazanium
CID 69263887
7-fluoro-5-(4-methoxyphenyl)-2-methyl-2,3-dihydro-1-benzofuran
CID 69108617
[7-(2,4-dichlorophenyl)-5-fluoro-2,3-dihydro-1-benzofuran-2-yl]methanamine
CID 11404165
7-(4-chlorophenyl)-2-methyl-2,3-dihydro-1-benzofuran
CID 143159059
N-[(5-methoxy-2-methyl-2,3-dihydro-1-benzofuran-7-yl)methyl]-4-methylcyclohexan-1-amine
CID 91642196
7-(2,6-dichlorophenyl)-2,5-dimethyl-2,3-dihydro-1-benzofuran
CID 69108438
[7-(2-chlorophenyl)-5-methoxy-2,3-dihydro-1-benzofuran-2-yl]methyl 4-methylbenzenesulfonate
CID 86599331
2,4-dichloro-1-(4-chloro-2-methoxyphenyl)benzene
CID 70266325

Frequently Asked Questions

What is the IUPAC name of 7-(2,4-dichlorophenyl)-5-methoxy-2-methyl-2,3-dihydro-1-benzofuran?
The IUPAC name of 7-(2,4-dichlorophenyl)-5-methoxy-2-methyl-2,3-dihydro-1-benzofuran (CID 69177577) is 7-(2,4-dichlorophenyl)-5-methoxy-2-methyl-2,3-dihydro-1-benzofuran.
What is the SMILES notation for 7-(2,4-dichlorophenyl)-5-methoxy-2-methyl-2,3-dihydro-1-benzofuran?
The canonical SMILES for 7-(2,4-dichlorophenyl)-5-methoxy-2-methyl-2,3-dihydro-1-benzofuran is COc1cc2c(c(-c3ccc(Cl)cc3Cl)c1)OC(C)C2.
What is the InChIKey of 7-(2,4-dichlorophenyl)-5-methoxy-2-methyl-2,3-dihydro-1-benzofuran?
The InChIKey is DNLDFSVLZRLFGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14Cl2O2/c1-9-5-10-6-12(19-2)8-14(16(10)20-9)13-4-3-11(17)7-15(13)18/h3-4,6-9H,5H2,1-2H3.
What are the key properties of 7-(2,4-dichlorophenyl)-5-methoxy-2-methyl-2,3-dihydro-1-benzofuran?
7-(2,4-dichlorophenyl)-5-methoxy-2-methyl-2,3-dihydro-1-benzofuran has a molecular weight of 309.19 g/mol, XLogP of 4.99, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(2,4-dichlorophenyl)-5-methoxy-2-methyl-2,3-dihydro-1-benzofuran is sourced from PubChem (CID 69177577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).