1,2-bis(difluoromethoxy)-4-ethylbenzene

C10H10F4O2 — CID 70298002

IUPAC1,2-bis(difluoromethoxy)-4-ethylbenzene
SMILESCCc1ccc(OC(F)F)c(OC(F)F)c1
InChIInChI=1S/C10H10F4O2/c1-2-6-3-4-7(15-9(11)12)8(5-6)16-10(13)14/h3-5,9-10H,2H2,1H3
InChIKeyVMXYVQITGVARNV-UHFFFAOYSA-N
MW238.18 g/mol
LogP3.45
Rot. Bonds5

About 1,2-bis(difluoromethoxy)-4-ethylbenzene

1,2-bis(difluoromethoxy)-4-ethylbenzene (PubChem CID 70298002) has the molecular formula C10H10F4O2 and a molecular weight of 238.18 g/mol. Its IUPAC name is 1,2-bis(difluoromethoxy)-4-ethylbenzene.

Molecular Properties

Compound Name1,2-bis(difluoromethoxy)-4-ethylbenzene
PubChem CID70298002
Molecular FormulaC10H10F4O2
Molecular Weight238.18 g/mol
Exact Mass238.06
IUPAC Name1,2-bis(difluoromethoxy)-4-ethylbenzene
SMILESCCc1ccc(OC(F)F)c(OC(F)F)c1
InChIInChI=1S/C10H10F4O2/c1-2-6-3-4-7(15-9(11)12)8(5-6)16-10(13)14/h3-5,9-10H,2H2,1H3
InChIKeyVMXYVQITGVARNV-UHFFFAOYSA-N
XLogP3.45
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.18
LogP ≤ 53.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-bromo-1-[2-(difluoromethoxy)-4-ethylphenyl]propan-1-one
CID 134624355
1-(difluoromethoxy)-4-ethylbenzene;ethane
CID 170568946
2-[4-(difluoromethoxy)-3-methoxyphenyl]acetonitrile
CID 4962241
N-[[3-(difluoromethoxy)-4-methoxyphenyl]methyl]-3-ethylpentan-3-amine
CID 65039727
1-(difluoromethoxy)-4-[4-(4-ethylphenyl)-2-fluorophenyl]-2-fluorobenzene
CID 67798587
2-[3-(difluoromethoxy)-4-methoxyphenyl]-N-methylethanamine
CID 64867479
N-[[4-(difluoromethoxy)-3-ethoxyphenyl]methyl]-2-methoxy-2-methylpropan-1-amine
CID 115656067
N-[[3-(difluoromethoxy)-4-methoxyphenyl]methyl]-2-ethylbutan-1-amine
CID 115581156
N-[[4-(difluoromethoxy)-3-fluorophenyl]methylideneamino]-1-(4-ethylphenyl)methanimine
CID 54572346
N-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl]-2-methylpropan-2-amine
CID 60760640
[4-(difluoromethoxy)-3-(trifluoromethoxy)phenyl]methanamine
CID 170998587
N-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl]-2-(4-ethylphenoxy)acetamide
CID 9261479

Frequently Asked Questions

What is the IUPAC name of 1,2-bis(difluoromethoxy)-4-ethylbenzene?
The IUPAC name of 1,2-bis(difluoromethoxy)-4-ethylbenzene (CID 70298002) is 1,2-bis(difluoromethoxy)-4-ethylbenzene.
What is the SMILES notation for 1,2-bis(difluoromethoxy)-4-ethylbenzene?
The canonical SMILES for 1,2-bis(difluoromethoxy)-4-ethylbenzene is CCc1ccc(OC(F)F)c(OC(F)F)c1.
What is the InChIKey of 1,2-bis(difluoromethoxy)-4-ethylbenzene?
The InChIKey is VMXYVQITGVARNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F4O2/c1-2-6-3-4-7(15-9(11)12)8(5-6)16-10(13)14/h3-5,9-10H,2H2,1H3.
What are the key properties of 1,2-bis(difluoromethoxy)-4-ethylbenzene?
1,2-bis(difluoromethoxy)-4-ethylbenzene has a molecular weight of 238.18 g/mol, XLogP of 3.45, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-bis(difluoromethoxy)-4-ethylbenzene is sourced from PubChem (CID 70298002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).