bis(cyclopenta-1,3-diene);1,2-dimethoxybenzene

C18H22O2 — CID 170157168

IUPACbis(cyclopenta-1,3-diene);1,2-dimethoxybenzene
SMILESC1=CCC=C1.C1=CCC=C1.COc1ccccc1OC
InChIInChI=1S/C8H10O2.2C5H6/c1-9-7-5-3-4-6-8(7)10-2;2*1-2-4-5-3-1/h3-6H,1-2H3;2*1-4H,5H2
InChIKeyYCRMGSULYWBIJI-UHFFFAOYSA-N
MW270.37 g/mol
LogP4.71
Rot. Bonds2

About bis(cyclopenta-1,3-diene);1,2-dimethoxybenzene

bis(cyclopenta-1,3-diene);1,2-dimethoxybenzene (PubChem CID 170157168) has the molecular formula C18H22O2 and a molecular weight of 270.37 g/mol. Its IUPAC name is bis(cyclopenta-1,3-diene);1,2-dimethoxybenzene.

Molecular Properties

Compound Namebis(cyclopenta-1,3-diene);1,2-dimethoxybenzene
PubChem CID170157168
Molecular FormulaC18H22O2
Molecular Weight270.37 g/mol
Exact Mass270.16
IUPAC Namebis(cyclopenta-1,3-diene);1,2-dimethoxybenzene
SMILESC1=CCC=C1.C1=CCC=C1.COc1ccccc1OC
InChIInChI=1S/C8H10O2.2C5H6/c1-9-7-5-3-4-6-8(7)10-2;2*1-2-4-5-3-1/h3-6H,1-2H3;2*1-4H,5H2
InChIKeyYCRMGSULYWBIJI-UHFFFAOYSA-N
XLogP4.71
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.37
LogP ≤ 54.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

azane;1,2-dimethoxybenzene
CID 174437926
1,2-dimethoxybenzene;dihydrochloride
CID 19834650
3-(2-methoxyphenyl)cyclohepta-1,3,5-triene
CID 144597097
1,2-dimethoxybenzene;molecular nitrogen;hydrochloride
CID 173306958
bis(2-methoxyphenyl)-dimethylphosphanium
CID 102310602
cyclopenta-1,3-diene;2-methyl-1H-pyrrole;ruthenium
CID 174581939
1-methoxy-2-methyliodanuidyloxybenzene
CID 163592566
1,2-bis[2-(2-methoxyphenyl)ethynyl]benzene
CID 11313747
1,2-dimethoxybenzene;propanal
CID 174258099
1-(chloromethoxy)-2-methoxybenzene
CID 12696124
[(1S)-1-(2-methoxyphenyl)ethyl]phosphane
CID 130462203
1-methoxy-2-[12-(2-methoxyphenoxy)dodecoxy]benzene
CID 134880850

Frequently Asked Questions

What is the IUPAC name of bis(cyclopenta-1,3-diene);1,2-dimethoxybenzene?
The IUPAC name of bis(cyclopenta-1,3-diene);1,2-dimethoxybenzene (CID 170157168) is bis(cyclopenta-1,3-diene);1,2-dimethoxybenzene.
What is the SMILES notation for bis(cyclopenta-1,3-diene);1,2-dimethoxybenzene?
The canonical SMILES for bis(cyclopenta-1,3-diene);1,2-dimethoxybenzene is C1=CCC=C1.C1=CCC=C1.COc1ccccc1OC.
What is the InChIKey of bis(cyclopenta-1,3-diene);1,2-dimethoxybenzene?
The InChIKey is YCRMGSULYWBIJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10O2.2C5H6/c1-9-7-5-3-4-6-8(7)10-2;2*1-2-4-5-3-1/h3-6H,1-2H3;2*1-4H,5H2.
What are the key properties of bis(cyclopenta-1,3-diene);1,2-dimethoxybenzene?
bis(cyclopenta-1,3-diene);1,2-dimethoxybenzene has a molecular weight of 270.37 g/mol, XLogP of 4.71, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for bis(cyclopenta-1,3-diene);1,2-dimethoxybenzene is sourced from PubChem (CID 170157168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).