8-methoxy-2-methylbicyclo[4.2.0]octa-1,3,5-triene

C10H12O — CID 105429225

IUPAC8-methoxy-2-methylbicyclo[4.2.0]octa-1,3,5-triene
SMILESCOC1Cc2cccc(C)c21
InChIInChI=1S/C10H12O/c1-7-4-3-5-8-6-9(11-2)10(7)8/h3-5,9H,6H2,1-2H3
InChIKeyJGQNMWGKPXZCGS-UHFFFAOYSA-N
MW148.20 g/mol
LogP2.24
Rot. Bonds1

About 8-methoxy-2-methylbicyclo[4.2.0]octa-1,3,5-triene

8-methoxy-2-methylbicyclo[4.2.0]octa-1,3,5-triene (PubChem CID 105429225) has the molecular formula C10H12O and a molecular weight of 148.20 g/mol. Its IUPAC name is 8-methoxy-2-methylbicyclo[4.2.0]octa-1,3,5-triene.

Molecular Properties

Compound Name8-methoxy-2-methylbicyclo[4.2.0]octa-1,3,5-triene
PubChem CID105429225
Molecular FormulaC10H12O
Molecular Weight148.20 g/mol
Exact Mass148.09
IUPAC Name8-methoxy-2-methylbicyclo[4.2.0]octa-1,3,5-triene
SMILESCOC1Cc2cccc(C)c21
InChIInChI=1S/C10H12O/c1-7-4-3-5-8-6-9(11-2)10(7)8/h3-5,9H,6H2,1-2H3
InChIKeyJGQNMWGKPXZCGS-UHFFFAOYSA-N
XLogP2.24
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.20
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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CID 105428926
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2-(4-methoxyphenyl)-7-methyl-2,3-dihydro-1H-indole
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CID 158553914
ethane;8-methyl-2,3a,4,8b-tetrahydro-1H-indeno[2,1-b]furan
CID 144690001
1,7-dimethoxy-2,3-dihydro-1H-indene
CID 139893728
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(4S)-N,5-dimethyl-3,4-dihydro-1H-isochromen-4-amine
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methyl 8-methyl-1,2,3,4-tetrahydronaphthalene-1-carboxylate
CID 12778765
8-methyl-1,2,3,4-tetrahydronaphthalene-1-thiol
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CID 82125541

Frequently Asked Questions

What is the IUPAC name of 8-methoxy-2-methylbicyclo[4.2.0]octa-1,3,5-triene?
The IUPAC name of 8-methoxy-2-methylbicyclo[4.2.0]octa-1,3,5-triene (CID 105429225) is 8-methoxy-2-methylbicyclo[4.2.0]octa-1,3,5-triene.
What is the SMILES notation for 8-methoxy-2-methylbicyclo[4.2.0]octa-1,3,5-triene?
The canonical SMILES for 8-methoxy-2-methylbicyclo[4.2.0]octa-1,3,5-triene is COC1Cc2cccc(C)c21.
What is the InChIKey of 8-methoxy-2-methylbicyclo[4.2.0]octa-1,3,5-triene?
The InChIKey is JGQNMWGKPXZCGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12O/c1-7-4-3-5-8-6-9(11-2)10(7)8/h3-5,9H,6H2,1-2H3.
What are the key properties of 8-methoxy-2-methylbicyclo[4.2.0]octa-1,3,5-triene?
8-methoxy-2-methylbicyclo[4.2.0]octa-1,3,5-triene has a molecular weight of 148.20 g/mol, XLogP of 2.24, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-methoxy-2-methylbicyclo[4.2.0]octa-1,3,5-triene is sourced from PubChem (CID 105429225), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).