1,2-difluoro-4,5-dimethoxybenzene

C8H8F2O2 — CID 853175

IUPAC1,2-difluoro-4,5-dimethoxybenzene
SMILESCOc1cc(F)c(F)cc1OC
InChIInChI=1S/C8H8F2O2/c1-11-7-3-5(9)6(10)4-8(7)12-2/h3-4H,1-2H3
InChIKeyWWAOVLXLTJXDGS-UHFFFAOYSA-N
MW174.15 g/mol
LogP1.98
Rot. Bonds2

About 1,2-difluoro-4,5-dimethoxybenzene

1,2-difluoro-4,5-dimethoxybenzene (PubChem CID 853175) has the molecular formula C8H8F2O2 and a molecular weight of 174.15 g/mol. Its IUPAC name is 1,2-difluoro-4,5-dimethoxybenzene.

Molecular Properties

Compound Name1,2-difluoro-4,5-dimethoxybenzene
PubChem CID853175
Molecular FormulaC8H8F2O2
Molecular Weight174.15 g/mol
Exact Mass174.05
IUPAC Name1,2-difluoro-4,5-dimethoxybenzene
SMILESCOc1cc(F)c(F)cc1OC
InChIInChI=1S/C8H8F2O2/c1-11-7-3-5(9)6(10)4-8(7)12-2/h3-4H,1-2H3
InChIKeyWWAOVLXLTJXDGS-UHFFFAOYSA-N
XLogP1.98
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.15
LogP ≤ 51.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

CID 89110154
CID 89110154
(1R)-1-(4,5-difluoro-2-methoxyphenyl)ethanamine
CID 55277831
2-(4,5-difluoro-2-methoxyphenyl)propan-2-ol
CID 84670502
2,5-difluoro-4-methoxyaniline
CID 45090681
1,2,4-trifluoro-3,5-dimethoxybenzene
CID 10535733
methyl 2-fluoro-4,5-dimethoxybenzoate
CID 86155175
CID 87823096
CID 87823096
(E)-1-(2-fluoro-4,5-dimethoxyphenyl)-N-methoxymethanimine
CID 91937675
1,2-difluoro-4-(3-fluoro-4-methoxyphenyl)benzene
CID 18930756
1-fluoro-5-methoxy-2,4-di(propan-2-yl)benzene
CID 59409851
2-fluoro-4-methoxy-5-methylaniline
CID 89371124
2,5-difluoro-4-methoxy-N-methylaniline
CID 82648042

Frequently Asked Questions

What is the IUPAC name of 1,2-difluoro-4,5-dimethoxybenzene?
The IUPAC name of 1,2-difluoro-4,5-dimethoxybenzene (CID 853175) is 1,2-difluoro-4,5-dimethoxybenzene.
What is the SMILES notation for 1,2-difluoro-4,5-dimethoxybenzene?
The canonical SMILES for 1,2-difluoro-4,5-dimethoxybenzene is COc1cc(F)c(F)cc1OC.
What is the InChIKey of 1,2-difluoro-4,5-dimethoxybenzene?
The InChIKey is WWAOVLXLTJXDGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8F2O2/c1-11-7-3-5(9)6(10)4-8(7)12-2/h3-4H,1-2H3.
What are the key properties of 1,2-difluoro-4,5-dimethoxybenzene?
1,2-difluoro-4,5-dimethoxybenzene has a molecular weight of 174.15 g/mol, XLogP of 1.98, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-difluoro-4,5-dimethoxybenzene is sourced from PubChem (CID 853175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).