ethane;1-ethoxy-2,4-difluorobenzene

C10H14F2O — CID 142043713

IUPACethane;1-ethoxy-2,4-difluorobenzene
SMILESCC.CCOc1ccc(F)cc1F
InChIInChI=1S/C8H8F2O.C2H6/c1-2-11-8-4-3-6(9)5-7(8)10;1-2/h3-5H,2H2,1H3;1-2H3
InChIKeyVACRITZIVPGKPR-UHFFFAOYSA-N
MW188.22 g/mol
LogP3.39
Rot. Bonds2

About ethane;1-ethoxy-2,4-difluorobenzene

ethane;1-ethoxy-2,4-difluorobenzene (PubChem CID 142043713) has the molecular formula C10H14F2O and a molecular weight of 188.22 g/mol. Its IUPAC name is ethane;1-ethoxy-2,4-difluorobenzene.

Molecular Properties

Compound Nameethane;1-ethoxy-2,4-difluorobenzene
PubChem CID142043713
Molecular FormulaC10H14F2O
Molecular Weight188.22 g/mol
Exact Mass188.10
IUPAC Nameethane;1-ethoxy-2,4-difluorobenzene
SMILESCC.CCOc1ccc(F)cc1F
InChIInChI=1S/C8H8F2O.C2H6/c1-2-11-8-4-3-6(9)5-7(8)10;1-2/h3-5H,2H2,1H3;1-2H3
InChIKeyVACRITZIVPGKPR-UHFFFAOYSA-N
XLogP3.39
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.22
LogP ≤ 53.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-ethoxy-2-fluoro-4-methylbenzene
CID 21057749
N-[(2,4-difluorophenyl)methyl]-4-ethoxy-3-fluoroaniline
CID 115587219
1-ethoxy-2-fluoro-4-iodobenzene
CID 50998221
1,4-diethoxy-2,5-difluorobenzene
CID 58718970
CID 89282398
CID 89282398
2-ethoxy-5-fluoro-N-methylaniline
CID 82268266
4-ethoxy-3-fluoro-N-methylaniline
CID 68516738
2-(2,4-difluorophenoxy)ethanethiol
CID 79002379
ethane;1-ethoxy-3,5-difluoro-2-methylbenzene
CID 169134909
1-chloro-2-ethoxy-4-fluorobenzene
CID 2773702
(2,4-difluorophenoxy)methyl-trifluoroboranuide
CID 63702065
4-(3-bromopropyl)-1-ethoxy-2-fluorobenzene
CID 118847164

Frequently Asked Questions

What is the IUPAC name of ethane;1-ethoxy-2,4-difluorobenzene?
The IUPAC name of ethane;1-ethoxy-2,4-difluorobenzene (CID 142043713) is ethane;1-ethoxy-2,4-difluorobenzene.
What is the SMILES notation for ethane;1-ethoxy-2,4-difluorobenzene?
The canonical SMILES for ethane;1-ethoxy-2,4-difluorobenzene is CC.CCOc1ccc(F)cc1F.
What is the InChIKey of ethane;1-ethoxy-2,4-difluorobenzene?
The InChIKey is VACRITZIVPGKPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8F2O.C2H6/c1-2-11-8-4-3-6(9)5-7(8)10;1-2/h3-5H,2H2,1H3;1-2H3.
What are the key properties of ethane;1-ethoxy-2,4-difluorobenzene?
ethane;1-ethoxy-2,4-difluorobenzene has a molecular weight of 188.22 g/mol, XLogP of 3.39, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;1-ethoxy-2,4-difluorobenzene is sourced from PubChem (CID 142043713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).