4-(2-ethenoxyethoxy)-1,2-dimethoxybenzene

C12H16O4 — CID 20722042

IUPAC4-(2-ethenoxyethoxy)-1,2-dimethoxybenzene
SMILESC=COCCOc1ccc(OC)c(OC)c1
InChIInChI=1S/C12H16O4/c1-4-15-7-8-16-10-5-6-11(13-2)12(9-10)14-3/h4-6,9H,1,7-8H2,2-3H3
InChIKeyYIOKUOLWRGPOGF-UHFFFAOYSA-N
MW224.26 g/mol
LogP2.24
Rot. Bonds7

About 4-(2-ethenoxyethoxy)-1,2-dimethoxybenzene

4-(2-ethenoxyethoxy)-1,2-dimethoxybenzene (PubChem CID 20722042) has the molecular formula C12H16O4 and a molecular weight of 224.26 g/mol. Its IUPAC name is 4-(2-ethenoxyethoxy)-1,2-dimethoxybenzene.

Molecular Properties

Compound Name4-(2-ethenoxyethoxy)-1,2-dimethoxybenzene
PubChem CID20722042
Molecular FormulaC12H16O4
Molecular Weight224.26 g/mol
Exact Mass224.10
IUPAC Name4-(2-ethenoxyethoxy)-1,2-dimethoxybenzene
SMILESC=COCCOc1ccc(OC)c(OC)c1
InChIInChI=1S/C12H16O4/c1-4-15-7-8-16-10-5-6-11(13-2)12(9-10)14-3/h4-6,9H,1,7-8H2,2-3H3
InChIKeyYIOKUOLWRGPOGF-UHFFFAOYSA-N
XLogP2.24
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.26
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-(2-ethenoxyethoxy)-4-methylbenzene
CID 21338012
1,4-dimethoxy-2-(2-methoxyethoxy)benzene
CID 132577892
4-(ethenoxymethyl)-1,2-dimethoxybenzene
CID 86205120
1,3-bis[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]benzene
CID 140750024
methyl (E)-3-[2,5-bis(2-ethenoxyethoxy)phenyl]-2-cyanoprop-2-enoate
CID 102507389
N-[4-(2-ethenoxyethoxy)phenyl]-4-methyl-N-(4-methylphenyl)aniline
CID 58251088
[3-methoxy-4-[6-[2-(4-methoxy-3-prop-2-enoyloxyphenoxy)ethoxy]naphthalen-2-yl]phenyl] prop-2-enoate
CID 144761458
(Z)-N-[2-(3,4-dimethoxyphenoxy)ethyl]-4-trimethylsilylbut-2-en-1-amine
CID 90054588
5-ethenyl-2-[2-[2-(4-ethenylphenoxy)ethoxy]ethoxy]-1,3-dimethoxybenzene
CID 11291660
1,2,3,5-tetramethoxybenzene;1,2,4-trimethoxybenzene
CID 54271001
3-(2-ethenoxyethoxy)benzonitrile
CID 66734813
bis(4-tert-butylphenyl)-[4-(2-ethenoxyethoxy)phenyl]phosphane
CID 151425397

Frequently Asked Questions

What is the IUPAC name of 4-(2-ethenoxyethoxy)-1,2-dimethoxybenzene?
The IUPAC name of 4-(2-ethenoxyethoxy)-1,2-dimethoxybenzene (CID 20722042) is 4-(2-ethenoxyethoxy)-1,2-dimethoxybenzene.
What is the SMILES notation for 4-(2-ethenoxyethoxy)-1,2-dimethoxybenzene?
The canonical SMILES for 4-(2-ethenoxyethoxy)-1,2-dimethoxybenzene is C=COCCOc1ccc(OC)c(OC)c1.
What is the InChIKey of 4-(2-ethenoxyethoxy)-1,2-dimethoxybenzene?
The InChIKey is YIOKUOLWRGPOGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16O4/c1-4-15-7-8-16-10-5-6-11(13-2)12(9-10)14-3/h4-6,9H,1,7-8H2,2-3H3.
What are the key properties of 4-(2-ethenoxyethoxy)-1,2-dimethoxybenzene?
4-(2-ethenoxyethoxy)-1,2-dimethoxybenzene has a molecular weight of 224.26 g/mol, XLogP of 2.24, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-ethenoxyethoxy)-1,2-dimethoxybenzene is sourced from PubChem (CID 20722042), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).