1,7-diethyldibenzofuran

C16H16O — CID 135251716

IUPAC1,7-diethyldibenzofuran
SMILESCCc1ccc2c(c1)oc1cccc(CC)c12
InChIInChI=1S/C16H16O/c1-3-11-8-9-13-15(10-11)17-14-7-5-6-12(4-2)16(13)14/h5-10H,3-4H2,1-2H3
InChIKeyMUCSZRMAZRNLCY-UHFFFAOYSA-N
MW224.30 g/mol
LogP4.71
Rot. Bonds2

About 1,7-diethyldibenzofuran

1,7-diethyldibenzofuran (PubChem CID 135251716) has the molecular formula C16H16O and a molecular weight of 224.30 g/mol. Its IUPAC name is 1,7-diethyldibenzofuran.

Molecular Properties

Compound Name1,7-diethyldibenzofuran
PubChem CID135251716
Molecular FormulaC16H16O
Molecular Weight224.30 g/mol
Exact Mass224.12
IUPAC Name1,7-diethyldibenzofuran
SMILESCCc1ccc2c(c1)oc1cccc(CC)c12
InChIInChI=1S/C16H16O/c1-3-11-8-9-13-15(10-11)17-14-7-5-6-12(4-2)16(13)14/h5-10H,3-4H2,1-2H3
InChIKeyMUCSZRMAZRNLCY-UHFFFAOYSA-N
XLogP4.71
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 54.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3-ethyldibenzofuran
CID 58510747
17-ethyl-9-oxapentacyclo[11.8.0.02,10.03,8.014,19]henicosa-1(13),2(10),3,5,7,11,14(19),15,17,20-decaene
CID 89117321
2,5-diethyl-9-methylcarbazole
CID 135251724
6-ethyl-2,3-dimethyl-1-benzofuran
CID 121007663
7-ethyl-4-methylchromen-2-one
CID 5160585
2,8-diethyldibenzofuran;3,7-diethyldibenzofuran;1,6-dimethyldibenzofuran;2,6-dimethyldibenzofuran;2,7-dimethyldibenzofuran;2,8-dimethyldibenzofuran;3,6-dimethyldibenzofuran;3,7-dimethyldibenzofuran
CID 159327549
9-(3-ethylphenyl)naphtho[2,1-b][1]benzofuran
CID 123472121
7-ethyl-4-(methoxymethyl)chromen-2-one
CID 88901844
8-[3-[3-(3-ethylphenyl)phenyl]phenyl]-19-oxapentacyclo[14.2.1.05,18.06,11.012,17]nonadeca-1,3,5,7,9,11,13,15,17-nonaene
CID 164568965
dibenzofuran-1-ylmethanethiol
CID 163683060
4-ethyl-2,3-dimethyl-1-benzofuran
CID 121007664
5-ethyl-[1]benzofuro[2,3-b]pyridine
CID 143904275

Frequently Asked Questions

What is the IUPAC name of 1,7-diethyldibenzofuran?
The IUPAC name of 1,7-diethyldibenzofuran (CID 135251716) is 1,7-diethyldibenzofuran.
What is the SMILES notation for 1,7-diethyldibenzofuran?
The canonical SMILES for 1,7-diethyldibenzofuran is CCc1ccc2c(c1)oc1cccc(CC)c12.
What is the InChIKey of 1,7-diethyldibenzofuran?
The InChIKey is MUCSZRMAZRNLCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16O/c1-3-11-8-9-13-15(10-11)17-14-7-5-6-12(4-2)16(13)14/h5-10H,3-4H2,1-2H3.
What are the key properties of 1,7-diethyldibenzofuran?
1,7-diethyldibenzofuran has a molecular weight of 224.30 g/mol, XLogP of 4.71, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,7-diethyldibenzofuran is sourced from PubChem (CID 135251716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).