2-ethyl-4-fluoro-1-(methoxymethoxy)benzene

C10H13FO2 — CID 177170323

IUPAC2-ethyl-4-fluoro-1-(methoxymethoxy)benzene
SMILESCCc1cc(F)ccc1OCOC
InChIInChI=1S/C10H13FO2/c1-3-8-6-9(11)4-5-10(8)13-7-12-2/h4-6H,3,7H2,1-2H3
InChIKeyFPKLAGDCOYKPNV-UHFFFAOYSA-N
MW184.21 g/mol
LogP2.37
Rot. Bonds4

About 2-ethyl-4-fluoro-1-(methoxymethoxy)benzene

2-ethyl-4-fluoro-1-(methoxymethoxy)benzene (PubChem CID 177170323) has the molecular formula C10H13FO2 and a molecular weight of 184.21 g/mol. Its IUPAC name is 2-ethyl-4-fluoro-1-(methoxymethoxy)benzene.

Molecular Properties

Compound Name2-ethyl-4-fluoro-1-(methoxymethoxy)benzene
PubChem CID177170323
Molecular FormulaC10H13FO2
Molecular Weight184.21 g/mol
Exact Mass184.09
IUPAC Name2-ethyl-4-fluoro-1-(methoxymethoxy)benzene
SMILESCCc1cc(F)ccc1OCOC
InChIInChI=1S/C10H13FO2/c1-3-8-6-9(11)4-5-10(8)13-7-12-2/h4-6H,3,7H2,1-2H3
InChIKeyFPKLAGDCOYKPNV-UHFFFAOYSA-N
XLogP2.37
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.21
LogP ≤ 52.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

2-(2-chloroethyl)-4-fluoro-1-(methoxymethoxy)benzene
CID 175391169
2-[5-fluoro-2-(methoxymethoxy)phenyl]acetonitrile
CID 67282069
N-[[5-fluoro-2-(methoxymethoxy)phenyl]methyl]propan-1-amine
CID 107695941
2-(2-ethyl-4-fluorophenoxy)ethanamine
CID 152850030
4-fluoro-2-(methoxymethoxy)-1-propan-2-yloxybenzene
CID 165354855
4-fluoro-2-(methoxymethoxy)-1-propan-2-ylbenzene
CID 177170739
2-(2-ethoxy-5-fluorophenyl)acetaldehyde
CID 83876013
1-[5-fluoro-2-(methoxymethoxy)phenyl]-1-hydroxyiminopropan-2-one
CID 167534916
methyl 5-ethyl-2-fluoro-4-(methoxymethoxy)benzoate
CID 67979097
4-ethyl-1,2-bis(methoxymethoxy)benzene
CID 59060180
2-(chloromethyl)-1-(methoxymethoxy)-4-methylbenzene
CID 65364631
2-ethyl-1,4-difluorobenzene
CID 23202513

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-4-fluoro-1-(methoxymethoxy)benzene?
The IUPAC name of 2-ethyl-4-fluoro-1-(methoxymethoxy)benzene (CID 177170323) is 2-ethyl-4-fluoro-1-(methoxymethoxy)benzene.
What is the SMILES notation for 2-ethyl-4-fluoro-1-(methoxymethoxy)benzene?
The canonical SMILES for 2-ethyl-4-fluoro-1-(methoxymethoxy)benzene is CCc1cc(F)ccc1OCOC.
What is the InChIKey of 2-ethyl-4-fluoro-1-(methoxymethoxy)benzene?
The InChIKey is FPKLAGDCOYKPNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13FO2/c1-3-8-6-9(11)4-5-10(8)13-7-12-2/h4-6H,3,7H2,1-2H3.
What are the key properties of 2-ethyl-4-fluoro-1-(methoxymethoxy)benzene?
2-ethyl-4-fluoro-1-(methoxymethoxy)benzene has a molecular weight of 184.21 g/mol, XLogP of 2.37, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-4-fluoro-1-(methoxymethoxy)benzene is sourced from PubChem (CID 177170323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).