2,7-dimethoxybiphenylene

C14H12O2 — CID 11287311

IUPAC2,7-dimethoxybiphenylene
SMILESCOc1ccc2c(c1)=c1cc(OC)ccc1=2
InChIInChI=1S/C14H12O2/c1-15-9-3-5-11-12-6-4-10(16-2)8-14(12)13(11)7-9/h3-8H,1-2H3
InChIKeyMGFUVMFFFFKZHD-UHFFFAOYSA-N
MW212.25 g/mol
LogP2.59
Rot. Bonds2

About 2,7-dimethoxybiphenylene

2,7-dimethoxybiphenylene (PubChem CID 11287311) has the molecular formula C14H12O2 and a molecular weight of 212.25 g/mol. Its IUPAC name is 2,7-dimethoxybiphenylene.

Molecular Properties

Compound Name2,7-dimethoxybiphenylene
PubChem CID11287311
Molecular FormulaC14H12O2
Molecular Weight212.25 g/mol
Exact Mass212.08
IUPAC Name2,7-dimethoxybiphenylene
SMILESCOc1ccc2c(c1)=c1cc(OC)ccc1=2
InChIInChI=1S/C14H12O2/c1-15-9-3-5-11-12-6-4-10(16-2)8-14(12)13(11)7-9/h3-8H,1-2H3
InChIKeyMGFUVMFFFFKZHD-UHFFFAOYSA-N
XLogP2.59
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.25
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,7-dimethoxybiphenylene?
The IUPAC name of 2,7-dimethoxybiphenylene (CID 11287311) is 2,7-dimethoxybiphenylene.
What is the SMILES notation for 2,7-dimethoxybiphenylene?
The canonical SMILES for 2,7-dimethoxybiphenylene is COc1ccc2c(c1)=c1cc(OC)ccc1=2.
What is the InChIKey of 2,7-dimethoxybiphenylene?
The InChIKey is MGFUVMFFFFKZHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12O2/c1-15-9-3-5-11-12-6-4-10(16-2)8-14(12)13(11)7-9/h3-8H,1-2H3.
What are the key properties of 2,7-dimethoxybiphenylene?
2,7-dimethoxybiphenylene has a molecular weight of 212.25 g/mol, XLogP of 2.59, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,7-dimethoxybiphenylene is sourced from PubChem (CID 11287311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).