2-ethoxy-1,4-difluoro-3-methoxybenzene

C9H10F2O2 — CID 146035302

IUPAC2-ethoxy-1,4-difluoro-3-methoxybenzene
SMILESCCOc1c(F)ccc(F)c1OC
InChIInChI=1S/C9H10F2O2/c1-3-13-9-7(11)5-4-6(10)8(9)12-2/h4-5H,3H2,1-2H3
InChIKeyATUJQKWZMNWHFC-UHFFFAOYSA-N
MW188.17 g/mol
LogP2.37
Rot. Bonds3

About 2-ethoxy-1,4-difluoro-3-methoxybenzene

2-ethoxy-1,4-difluoro-3-methoxybenzene (PubChem CID 146035302) has the molecular formula C9H10F2O2 and a molecular weight of 188.17 g/mol. Its IUPAC name is 2-ethoxy-1,4-difluoro-3-methoxybenzene.

Molecular Properties

Compound Name2-ethoxy-1,4-difluoro-3-methoxybenzene
PubChem CID146035302
Molecular FormulaC9H10F2O2
Molecular Weight188.17 g/mol
Exact Mass188.06
IUPAC Name2-ethoxy-1,4-difluoro-3-methoxybenzene
SMILESCCOc1c(F)ccc(F)c1OC
InChIInChI=1S/C9H10F2O2/c1-3-13-9-7(11)5-4-6(10)8(9)12-2/h4-5H,3H2,1-2H3
InChIKeyATUJQKWZMNWHFC-UHFFFAOYSA-N
XLogP2.37
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.17
LogP ≤ 52.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1,2-dibromo-3-ethoxy-4-fluorobenzene
CID 118847248
2-ethoxy-1,3-difluoro-4-methylsulfanylbenzene
CID 164894235
1-bromo-4-fluoro-2,3-dimethoxybenzene
CID 58420229
2-ethoxy-3,4-difluoroaniline
CID 22118017
1-bromo-2,4-difluoro-3-methoxybenzene
CID 18371109
1-fluoro-2-methoxy-4-methyl-3-propan-2-yloxybenzene
CID 130057945
3-ethoxy-2,4-difluorobenzenesulfonyl chloride
CID 86811459
1-(2,2-dimethylpropyl)-2,4-difluoro-3-methoxybenzene
CID 59139832
1-(2-chloro-3-ethoxy-4-fluorophenyl)ethanone
CID 171005984
(4-ethoxy-3-fluoro-5-methoxyphenyl)boronic acid
CID 164891882
O-ethyl 4-fluoro-3-methoxy-2-methylbenzenecarbothioate
CID 54395730
1-chloro-2-ethoxy-4-fluoro-3-methylsulfanylbenzene
CID 164893633

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-1,4-difluoro-3-methoxybenzene?
The IUPAC name of 2-ethoxy-1,4-difluoro-3-methoxybenzene (CID 146035302) is 2-ethoxy-1,4-difluoro-3-methoxybenzene.
What is the SMILES notation for 2-ethoxy-1,4-difluoro-3-methoxybenzene?
The canonical SMILES for 2-ethoxy-1,4-difluoro-3-methoxybenzene is CCOc1c(F)ccc(F)c1OC.
What is the InChIKey of 2-ethoxy-1,4-difluoro-3-methoxybenzene?
The InChIKey is ATUJQKWZMNWHFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10F2O2/c1-3-13-9-7(11)5-4-6(10)8(9)12-2/h4-5H,3H2,1-2H3.
What are the key properties of 2-ethoxy-1,4-difluoro-3-methoxybenzene?
2-ethoxy-1,4-difluoro-3-methoxybenzene has a molecular weight of 188.17 g/mol, XLogP of 2.37, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-1,4-difluoro-3-methoxybenzene is sourced from PubChem (CID 146035302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).