4-ethenyl-1,2-bis(methoxymethoxy)benzene

C12H16O4 — CID 57430947

IUPAC4-ethenyl-1,2-bis(methoxymethoxy)benzene
SMILESC=Cc1ccc(OCOC)c(OCOC)c1
InChIInChI=1S/C12H16O4/c1-4-10-5-6-11(15-8-13-2)12(7-10)16-9-14-3/h4-7H,1,8-9H2,2-3H3
InChIKeyAWKQRSNBDFPHKY-UHFFFAOYSA-N
MW224.26 g/mol
LogP2.30
Rot. Bonds7

About 4-ethenyl-1,2-bis(methoxymethoxy)benzene

4-ethenyl-1,2-bis(methoxymethoxy)benzene (PubChem CID 57430947) has the molecular formula C12H16O4 and a molecular weight of 224.26 g/mol. Its IUPAC name is 4-ethenyl-1,2-bis(methoxymethoxy)benzene.

Molecular Properties

Compound Name4-ethenyl-1,2-bis(methoxymethoxy)benzene
PubChem CID57430947
Molecular FormulaC12H16O4
Molecular Weight224.26 g/mol
Exact Mass224.10
IUPAC Name4-ethenyl-1,2-bis(methoxymethoxy)benzene
SMILESC=Cc1ccc(OCOC)c(OCOC)c1
InChIInChI=1S/C12H16O4/c1-4-10-5-6-11(15-8-13-2)12(7-10)16-9-14-3/h4-7H,1,8-9H2,2-3H3
InChIKeyAWKQRSNBDFPHKY-UHFFFAOYSA-N
XLogP2.30
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 ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-ethenyl-2-methoxy-1-(methoxymethoxy)benzene
CID 59623316
3,4-bis(methoxymethoxy)benzaldehyde
CID 11746314
1,2-bis(methoxymethoxy)-4-[(E)-prop-1-enyl]benzene
CID 58923294
1-methoxy-2-(methoxymethoxy)-4-[(E)-2-[4-[(E)-2-[4-methoxy-3-(methoxymethoxy)phenyl]ethenyl]phenyl]ethenyl]benzene
CID 11730255
4-ethenyl-2-ethoxy-1-methoxybenzene
CID 11665489
4-ethenyl-1,2-dimethoxybenzene
CID 159733418
2-[(4-ethenyl-2-ethoxyphenoxy)methoxy]ethyl-trimethylsilane
CID 168749605
4-[(E)-2-[3,4-bis(methoxymethoxy)phenyl]ethenyl]benzenesulfonamide
CID 68976551
methyl 4-[4-[3,4-bis(methoxymethoxy)phenyl]buta-1,3-dienyl]benzoate
CID 91216222
1,2-bis(methoxymethoxy)-4-[(1E,3E)-4-(4-nitrophenyl)buta-1,3-dienyl]benzene
CID 87641751
(1R)-1-[3-methoxy-4-(methoxymethoxy)phenyl]prop-2-en-1-ol
CID 125478495
methyl 2-(4-ethenyl-2-methoxyphenoxy)acetate
CID 167145651

Frequently Asked Questions

What is the IUPAC name of 4-ethenyl-1,2-bis(methoxymethoxy)benzene?
The IUPAC name of 4-ethenyl-1,2-bis(methoxymethoxy)benzene (CID 57430947) is 4-ethenyl-1,2-bis(methoxymethoxy)benzene.
What is the SMILES notation for 4-ethenyl-1,2-bis(methoxymethoxy)benzene?
The canonical SMILES for 4-ethenyl-1,2-bis(methoxymethoxy)benzene is C=Cc1ccc(OCOC)c(OCOC)c1.
What is the InChIKey of 4-ethenyl-1,2-bis(methoxymethoxy)benzene?
The InChIKey is AWKQRSNBDFPHKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16O4/c1-4-10-5-6-11(15-8-13-2)12(7-10)16-9-14-3/h4-7H,1,8-9H2,2-3H3.
What are the key properties of 4-ethenyl-1,2-bis(methoxymethoxy)benzene?
4-ethenyl-1,2-bis(methoxymethoxy)benzene has a molecular weight of 224.26 g/mol, XLogP of 2.30, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethenyl-1,2-bis(methoxymethoxy)benzene is sourced from PubChem (CID 57430947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).