3-ethyl-4a,9b-dihydrodibenzofuran

C14H14O — CID 142358862

IUPAC3-ethyl-4a,9b-dihydrodibenzofuran
SMILESCCC1=CC2Oc3ccccc3C2C=C1
InChIInChI=1S/C14H14O/c1-2-10-7-8-12-11-5-3-4-6-13(11)15-14(12)9-10/h3-9,12,14H,2H2,1H3
InChIKeyXSMZVLASFKHLDH-UHFFFAOYSA-N
MW198.26 g/mol
LogP3.44
Rot. Bonds1

About 3-ethyl-4a,9b-dihydrodibenzofuran

3-ethyl-4a,9b-dihydrodibenzofuran (PubChem CID 142358862) has the molecular formula C14H14O and a molecular weight of 198.26 g/mol. Its IUPAC name is 3-ethyl-4a,9b-dihydrodibenzofuran.

Molecular Properties

Compound Name3-ethyl-4a,9b-dihydrodibenzofuran
PubChem CID142358862
Molecular FormulaC14H14O
Molecular Weight198.26 g/mol
Exact Mass198.10
IUPAC Name3-ethyl-4a,9b-dihydrodibenzofuran
SMILESCCC1=CC2Oc3ccccc3C2C=C1
InChIInChI=1S/C14H14O/c1-2-10-7-8-12-11-5-3-4-6-13(11)15-14(12)9-10/h3-9,12,14H,2H2,1H3
InChIKeyXSMZVLASFKHLDH-UHFFFAOYSA-N
XLogP3.44
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.26
LogP ≤ 53.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-[4-(4a,9b-dihydrodibenzofuran-3-yl)phenyl]-7-phenyl-N-[4-(4-phenylphenyl)phenyl]bicyclo[4.1.0]hepta-1(6),2,4-trien-3-amine
CID 166777333
(1S,2R,6S)-17-ethyl-4-methyl-13-oxa-4-azatetracyclo[12.4.1.02,6.07,12]nonadeca-7,9,11,15,17-pentaen-5-one
CID 144548878
N,N-diphenyl-4a,9b-dihydrodibenzofuran-1-amine
CID 164737748
(4S)-2-(2-ethylphenyl)-3,4-dihydro-2H-chromen-4-ol
CID 104949776
3-hydroxy-4a,9a-dihydroxanthen-9-one
CID 50742130
9-[9-(4a,9b-dihydrodibenzofuran-3-yl)dibenzothiophen-3-yl]carbazole
CID 170286309
1-(2-iodobutyl)-5a,11a-dihydronaphtho[2,3-b][1]benzofuran
CID 170227599
(3-ethyl-1H-inden-1-yl)-trimethylsilane
CID 135047164
2-ethoxy-3-fluoro-2,3-dihydro-1-benzofuran
CID 141453063
(4S)-2-(4-ethylphenyl)-3,4-dihydro-2H-chromen-4-amine
CID 104945818
(3R,4S)-3,4-dimethyl-3,4-dihydro-2H-chromen-2-ol
CID 164679988
9-methyl-9H-xanthene;propane
CID 143256907

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-4a,9b-dihydrodibenzofuran?
The IUPAC name of 3-ethyl-4a,9b-dihydrodibenzofuran (CID 142358862) is 3-ethyl-4a,9b-dihydrodibenzofuran.
What is the SMILES notation for 3-ethyl-4a,9b-dihydrodibenzofuran?
The canonical SMILES for 3-ethyl-4a,9b-dihydrodibenzofuran is CCC1=CC2Oc3ccccc3C2C=C1.
What is the InChIKey of 3-ethyl-4a,9b-dihydrodibenzofuran?
The InChIKey is XSMZVLASFKHLDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14O/c1-2-10-7-8-12-11-5-3-4-6-13(11)15-14(12)9-10/h3-9,12,14H,2H2,1H3.
What are the key properties of 3-ethyl-4a,9b-dihydrodibenzofuran?
3-ethyl-4a,9b-dihydrodibenzofuran has a molecular weight of 198.26 g/mol, XLogP of 3.44, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-4a,9b-dihydrodibenzofuran is sourced from PubChem (CID 142358862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).