1-ethoxy-2,3-difluorobenzene

C8H8F2O — CID 2782928

IUPAC1-ethoxy-2,3-difluorobenzene
SMILESCCOc1cccc(F)c1F
InChIInChI=1S/C8H8F2O/c1-2-11-7-5-3-4-6(9)8(7)10/h3-5H,2H2,1H3
InChIKeyAVOGLGBKOFOSBN-UHFFFAOYSA-N
MW158.15 g/mol
LogP2.36
Rot. Bonds2

About 1-ethoxy-2,3-difluorobenzene

1-ethoxy-2,3-difluorobenzene (PubChem CID 2782928) has the molecular formula C8H8F2O and a molecular weight of 158.15 g/mol. Its IUPAC name is 1-ethoxy-2,3-difluorobenzene.

Molecular Properties

Compound Name1-ethoxy-2,3-difluorobenzene
PubChem CID2782928
Molecular FormulaC8H8F2O
Molecular Weight158.15 g/mol
Exact Mass158.05
IUPAC Name1-ethoxy-2,3-difluorobenzene
SMILESCCOc1cccc(F)c1F
InChIInChI=1S/C8H8F2O/c1-2-11-7-5-3-4-6(9)8(7)10/h3-5H,2H2,1H3
InChIKeyAVOGLGBKOFOSBN-UHFFFAOYSA-N
XLogP2.36
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.15
LogP ≤ 52.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Phenoxyethanol
CID 31236
Phenyl glycidyl ether
CID 31217
Diphenyl Ether
CID 7583
Anisole
CID 7519
Phenyl acetate
CID 31229
1-Phenoxy-2-propanol
CID 92839
1,4-Dimethoxybenzene
CID 9016
4-Ethoxyphenol
CID 12150
Phenetole
CID 7674
1,2-Diphenoxyethane
CID 7713
Phenoxyethyl propionate
CID 31954
2-Phenoxy-1-propanol
CID 20129

Frequently Asked Questions

What is the IUPAC name of 1-ethoxy-2,3-difluorobenzene?
The IUPAC name of 1-ethoxy-2,3-difluorobenzene (CID 2782928) is 1-ethoxy-2,3-difluorobenzene.
What is the SMILES notation for 1-ethoxy-2,3-difluorobenzene?
The canonical SMILES for 1-ethoxy-2,3-difluorobenzene is CCOc1cccc(F)c1F.
What is the InChIKey of 1-ethoxy-2,3-difluorobenzene?
The InChIKey is AVOGLGBKOFOSBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8F2O/c1-2-11-7-5-3-4-6(9)8(7)10/h3-5H,2H2,1H3.
What are the key properties of 1-ethoxy-2,3-difluorobenzene?
1-ethoxy-2,3-difluorobenzene has a molecular weight of 158.15 g/mol, XLogP of 2.36, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethoxy-2,3-difluorobenzene is sourced from PubChem (CID 2782928), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).