3-ethyl-2-[(Z)-prop-1-enyl]benzo[g][1]benzofuran

C17H16O — CID 176956265

IUPAC3-ethyl-2-[(Z)-prop-1-enyl]benzo[g][1]benzofuran
SMILESC/C=C\c1oc2c(ccc3ccccc32)c1CC
InChIInChI=1S/C17H16O/c1-3-7-16-13(4-2)15-11-10-12-8-5-6-9-14(12)17(15)18-16/h3,5-11H,4H2,1-2H3/b7-3-
InChIKeyWGFYKPFRXVDDGD-CLTKARDFSA-N
MW236.31 g/mol
LogP5.18
Rot. Bonds2

About 3-ethyl-2-[(Z)-prop-1-enyl]benzo[g][1]benzofuran

3-ethyl-2-[(Z)-prop-1-enyl]benzo[g][1]benzofuran (PubChem CID 176956265) has the molecular formula C17H16O and a molecular weight of 236.31 g/mol. Its IUPAC name is 3-ethyl-2-[(Z)-prop-1-enyl]benzo[g][1]benzofuran.

Molecular Properties

Compound Name3-ethyl-2-[(Z)-prop-1-enyl]benzo[g][1]benzofuran
PubChem CID176956265
Molecular FormulaC17H16O
Molecular Weight236.31 g/mol
Exact Mass236.12
IUPAC Name3-ethyl-2-[(Z)-prop-1-enyl]benzo[g][1]benzofuran
SMILESC/C=C\c1oc2c(ccc3ccccc32)c1CC
InChIInChI=1S/C17H16O/c1-3-7-16-13(4-2)15-11-10-12-8-5-6-9-14(12)17(15)18-16/h3,5-11H,4H2,1-2H3/b7-3-
InChIKeyWGFYKPFRXVDDGD-CLTKARDFSA-N
XLogP5.18
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500236.31
LogP ≤ 55.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

10-[3-[3-[3-ethyl-2-[(Z)-prop-1-enyl]-1-benzofuran-6-yl]phenyl]phenyl]-11H-benzo[a]carbazole
CID 142569223
1-ethenyl-2-[(Z)-prop-1-enyl]benzo[e][1]benzofuran
CID 134365271
ethane;(Z)-N-[3-ethyl-2-[(Z)-prop-1-enyl]-1-benzofuran-7-yl]-2-(4-methylphenyl)but-2-en-1-imine
CID 145313010
1,2-bis[(E)-prop-1-enyl]naphthalene
CID 19743380
2-methyl-1-prop-1-enylnaphthalene
CID 123646968
10-methylnaphtho[1,2-b][1]benzofuran
CID 58510874
2-oxobenzo[h]chromene-4-carbaldehyde
CID 11989493
4,4,5,5-tetramethyl-2-[4-[1-[3-[(Z)-prop-1-enyl]benzo[g][1]benzofuran-2-yl]ethenyl]phenyl]-1,3,2-dioxaborolane
CID 174046439
1-ethyl-2-fluoronaphthalene
CID 19065482
10-ethylpentacyclo[12.8.0.02,11.04,9.015,20]docosa-1(14),2,4,6,8,10,12,15,17,19,21-undecaene
CID 142255982
3-ethenyl-2-[(Z)-prop-1-enyl]-6H-furo[3,2-c]carbazole
CID 145021144
2-phenyl-3-propan-2-ylbenzo[g][1]benzofuran
CID 11565470

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-2-[(Z)-prop-1-enyl]benzo[g][1]benzofuran?
The IUPAC name of 3-ethyl-2-[(Z)-prop-1-enyl]benzo[g][1]benzofuran (CID 176956265) is 3-ethyl-2-[(Z)-prop-1-enyl]benzo[g][1]benzofuran.
What is the SMILES notation for 3-ethyl-2-[(Z)-prop-1-enyl]benzo[g][1]benzofuran?
The canonical SMILES for 3-ethyl-2-[(Z)-prop-1-enyl]benzo[g][1]benzofuran is C/C=C\c1oc2c(ccc3ccccc32)c1CC.
What is the InChIKey of 3-ethyl-2-[(Z)-prop-1-enyl]benzo[g][1]benzofuran?
The InChIKey is WGFYKPFRXVDDGD-CLTKARDFSA-N. The full InChI is InChI=1S/C17H16O/c1-3-7-16-13(4-2)15-11-10-12-8-5-6-9-14(12)17(15)18-16/h3,5-11H,4H2,1-2H3/b7-3-.
What are the key properties of 3-ethyl-2-[(Z)-prop-1-enyl]benzo[g][1]benzofuran?
3-ethyl-2-[(Z)-prop-1-enyl]benzo[g][1]benzofuran has a molecular weight of 236.31 g/mol, XLogP of 5.18, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-2-[(Z)-prop-1-enyl]benzo[g][1]benzofuran is sourced from PubChem (CID 176956265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).