4-methyl-6H-cyclohepta[b][1]benzofuran

C14H12O — CID 144724082

IUPAC4-methyl-6H-cyclohepta[b][1]benzofuran
SMILESCc1cccc2c3c(oc12)CC=CC=C3
InChIInChI=1S/C14H12O/c1-10-6-5-8-12-11-7-3-2-4-9-13(11)15-14(10)12/h2-8H,9H2,1H3
InChIKeyCTYZPLYPKWCZHU-UHFFFAOYSA-N
MW196.25 g/mol
LogP3.87
Rot. Bonds

About 4-methyl-6H-cyclohepta[b][1]benzofuran

4-methyl-6H-cyclohepta[b][1]benzofuran (PubChem CID 144724082) has the molecular formula C14H12O and a molecular weight of 196.25 g/mol. Its IUPAC name is 4-methyl-6H-cyclohepta[b][1]benzofuran.

Molecular Properties

Compound Name4-methyl-6H-cyclohepta[b][1]benzofuran
PubChem CID144724082
Molecular FormulaC14H12O
Molecular Weight196.25 g/mol
Exact Mass196.09
IUPAC Name4-methyl-6H-cyclohepta[b][1]benzofuran
SMILESCc1cccc2c3c(oc12)CC=CC=C3
InChIInChI=1S/C14H12O/c1-10-6-5-8-12-11-7-3-2-4-9-13(11)15-14(10)12/h2-8H,9H2,1H3
InChIKeyCTYZPLYPKWCZHU-UHFFFAOYSA-N
XLogP3.87
TPSA13.14 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 53.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

5-methyl-1,2,3,4-tetrahydroxanthen-9-one
CID 91665355
1-iodo-6-methyldibenzofuran
CID 137496766
dicyclohexyloxy(11-oxatetracyclo[8.8.0.02,7.012,18]octadeca-1(10),2,4,6,8,12(18),14,16-octaen-9-yl)borane
CID 163827282
4-hydroxy-8-methylchromen-2-one
CID 54676122
2-N,4-N,3-triphenyl-2-N-(4-phenylphenyl)-6H-cyclohepta[b][1]benzofuran-2,4-diamine
CID 145265088
2,2,7-trimethylpyrano[3,2-c]chromen-5-one
CID 13045727
ethane;2-N,4-N,3-triphenyl-2-N-(4-phenylphenyl)-6H-cyclohepta[b][1]benzofuran-2,4-diamine
CID 145265087
cyclohexa-1,3-diene;1,2-xylene
CID 159360183
10-methylnaphtho[1,2-b][1]benzofuran
CID 58510874
4-[3-[3-(6H-cyclohepta[b][1]benzofuran-4-yl)phenyl]phenyl]-5-(6-dibenzofuran-3-yl-2-phenylpyrimidin-4-yl)benzo[b]carbazole;ethane
CID 142568613
6-(6-methyldibenzofuran-4-yl)-7H-cyclohepta[b][1]benzofuran
CID 146531811
methyl 8-methyl-2-oxochromene-4-carboxylate
CID 12008880

Frequently Asked Questions

What is the IUPAC name of 4-methyl-6H-cyclohepta[b][1]benzofuran?
The IUPAC name of 4-methyl-6H-cyclohepta[b][1]benzofuran (CID 144724082) is 4-methyl-6H-cyclohepta[b][1]benzofuran.
What is the SMILES notation for 4-methyl-6H-cyclohepta[b][1]benzofuran?
The canonical SMILES for 4-methyl-6H-cyclohepta[b][1]benzofuran is Cc1cccc2c3c(oc12)CC=CC=C3.
What is the InChIKey of 4-methyl-6H-cyclohepta[b][1]benzofuran?
The InChIKey is CTYZPLYPKWCZHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12O/c1-10-6-5-8-12-11-7-3-2-4-9-13(11)15-14(10)12/h2-8H,9H2,1H3.
What are the key properties of 4-methyl-6H-cyclohepta[b][1]benzofuran?
4-methyl-6H-cyclohepta[b][1]benzofuran has a molecular weight of 196.25 g/mol, XLogP of 3.87, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-6H-cyclohepta[b][1]benzofuran is sourced from PubChem (CID 144724082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).