1,2-difluoro-3-(2-methoxyphenyl)benzene

C13H10F2O — CID 57230342

IUPAC1,2-difluoro-3-(2-methoxyphenyl)benzene
SMILESCOc1ccccc1-c1cccc(F)c1F
InChIInChI=1S/C13H10F2O/c1-16-12-8-3-2-5-9(12)10-6-4-7-11(14)13(10)15/h2-8H,1H3
InChIKeyDCPQVVWUVMTYDH-UHFFFAOYSA-N
MW220.22 g/mol
LogP3.64
Rot. Bonds2

About 1,2-difluoro-3-(2-methoxyphenyl)benzene

1,2-difluoro-3-(2-methoxyphenyl)benzene (PubChem CID 57230342) has the molecular formula C13H10F2O and a molecular weight of 220.22 g/mol. Its IUPAC name is 1,2-difluoro-3-(2-methoxyphenyl)benzene.

Molecular Properties

Compound Name1,2-difluoro-3-(2-methoxyphenyl)benzene
PubChem CID57230342
Molecular FormulaC13H10F2O
Molecular Weight220.22 g/mol
Exact Mass220.07
IUPAC Name1,2-difluoro-3-(2-methoxyphenyl)benzene
SMILESCOc1ccccc1-c1cccc(F)c1F
InChIInChI=1S/C13H10F2O/c1-16-12-8-3-2-5-9(12)10-6-4-7-11(14)13(10)15/h2-8H,1H3
InChIKeyDCPQVVWUVMTYDH-UHFFFAOYSA-N
XLogP3.64
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.22
LogP ≤ 53.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2,3-difluoro-1,4-bis(2-methoxyphenyl)benzene
CID 58004087
2-(2,3-difluorophenyl)-6-methoxyphenol
CID 83130446
1,2-difluoro-3-(2-methoxy-5-methylphenyl)benzene
CID 119008947
1-fluoro-2-(2-fluorophenyl)-3-methoxybenzene
CID 46312197
2-(2-fluoro-3-methoxyphenyl)phenol
CID 53218569
1,2-difluoro-3-(4-methoxyphenyl)benzene
CID 59532996
1-(difluoromethyl)-2-(2,3-difluorophenyl)-3-methoxybenzene
CID 119003077
1,2-difluoro-3-(2-fluorophenyl)benzene;methanol
CID 70977056
1,3-difluoro-2-(2-methoxyphenyl)benzene;isothiocyanic acid
CID 175606865
1-[2-(2-methoxyphenyl)phenyl]naphthalene
CID 175027379
1-fluoro-4-methoxy-2-(2-methoxyphenyl)benzene
CID 69262125
2-fluoro-1-(2-methoxyphenyl)-4-methylbenzene
CID 155698567

Frequently Asked Questions

What is the IUPAC name of 1,2-difluoro-3-(2-methoxyphenyl)benzene?
The IUPAC name of 1,2-difluoro-3-(2-methoxyphenyl)benzene (CID 57230342) is 1,2-difluoro-3-(2-methoxyphenyl)benzene.
What is the SMILES notation for 1,2-difluoro-3-(2-methoxyphenyl)benzene?
The canonical SMILES for 1,2-difluoro-3-(2-methoxyphenyl)benzene is COc1ccccc1-c1cccc(F)c1F.
What is the InChIKey of 1,2-difluoro-3-(2-methoxyphenyl)benzene?
The InChIKey is DCPQVVWUVMTYDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10F2O/c1-16-12-8-3-2-5-9(12)10-6-4-7-11(14)13(10)15/h2-8H,1H3.
What are the key properties of 1,2-difluoro-3-(2-methoxyphenyl)benzene?
1,2-difluoro-3-(2-methoxyphenyl)benzene has a molecular weight of 220.22 g/mol, XLogP of 3.64, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-difluoro-3-(2-methoxyphenyl)benzene is sourced from PubChem (CID 57230342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).