1,2-bis(methoxymethoxy)-4-[(E)-prop-1-enyl]benzene

C13H18O4 — CID 58923294

IUPAC1,2-bis(methoxymethoxy)-4-[(E)-prop-1-enyl]benzene
SMILESC/C=C/c1ccc(OCOC)c(OCOC)c1
InChIInChI=1S/C13H18O4/c1-4-5-11-6-7-12(16-9-14-2)13(8-11)17-10-15-3/h4-8H,9-10H2,1-3H3/b5-4+
InChIKeyYOCNYPOVSHFMEW-SNAWJCMRSA-N
MW238.28 g/mol
LogP2.69
Rot. Bonds7

About 1,2-bis(methoxymethoxy)-4-[(E)-prop-1-enyl]benzene

1,2-bis(methoxymethoxy)-4-[(E)-prop-1-enyl]benzene (PubChem CID 58923294) has the molecular formula C13H18O4 and a molecular weight of 238.28 g/mol. Its IUPAC name is 1,2-bis(methoxymethoxy)-4-[(E)-prop-1-enyl]benzene.

Molecular Properties

Compound Name1,2-bis(methoxymethoxy)-4-[(E)-prop-1-enyl]benzene
PubChem CID58923294
Molecular FormulaC13H18O4
Molecular Weight238.28 g/mol
Exact Mass238.12
IUPAC Name1,2-bis(methoxymethoxy)-4-[(E)-prop-1-enyl]benzene
SMILESC/C=C/c1ccc(OCOC)c(OCOC)c1
InChIInChI=1S/C13H18O4/c1-4-5-11-6-7-12(16-9-14-2)13(8-11)17-10-15-3/h4-8H,9-10H2,1-3H3/b5-4+
InChIKeyYOCNYPOVSHFMEW-SNAWJCMRSA-N
XLogP2.69
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.28
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 1,2-bis(methoxymethoxy)-4-[(E)-prop-1-enyl]benzene with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-methoxy-2-(methoxymethoxy)-4-[(E)-2-[4-[(E)-2-[4-methoxy-3-(methoxymethoxy)phenyl]ethenyl]phenyl]ethenyl]benzene
CID 11730255
3,4-bis(methoxymethoxy)benzaldehyde
CID 11746314
4-ethenyl-1,2-bis(methoxymethoxy)benzene
CID 57430947
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
4-ethenyl-2-methoxy-1-(methoxymethoxy)benzene
CID 59623316
2-[4-[2-[3,4-bis(methoxymethoxy)phenyl]ethenyl]phenyl]acetamide
CID 90856781
2-[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]ethanamine
CID 62582661
4-[3-methoxy-4-(methoxymethoxy)phenyl]but-3-en-1-ol
CID 54330886
1-(3-methoxypropoxy)-2-phenylmethoxy-4-[(E)-prop-1-enyl]benzene
CID 90350663
2-[[2-methoxy-4-[(E)-prop-1-enyl]phenoxy]methoxymethyl]-2-methyloxirane
CID 88894201

Frequently Asked Questions

What is the IUPAC name of 1,2-bis(methoxymethoxy)-4-[(E)-prop-1-enyl]benzene?
The IUPAC name of 1,2-bis(methoxymethoxy)-4-[(E)-prop-1-enyl]benzene (CID 58923294) is 1,2-bis(methoxymethoxy)-4-[(E)-prop-1-enyl]benzene.
What is the SMILES notation for 1,2-bis(methoxymethoxy)-4-[(E)-prop-1-enyl]benzene?
The canonical SMILES for 1,2-bis(methoxymethoxy)-4-[(E)-prop-1-enyl]benzene is C/C=C/c1ccc(OCOC)c(OCOC)c1.
What is the InChIKey of 1,2-bis(methoxymethoxy)-4-[(E)-prop-1-enyl]benzene?
The InChIKey is YOCNYPOVSHFMEW-SNAWJCMRSA-N. The full InChI is InChI=1S/C13H18O4/c1-4-5-11-6-7-12(16-9-14-2)13(8-11)17-10-15-3/h4-8H,9-10H2,1-3H3/b5-4+.
What are the key properties of 1,2-bis(methoxymethoxy)-4-[(E)-prop-1-enyl]benzene?
1,2-bis(methoxymethoxy)-4-[(E)-prop-1-enyl]benzene has a molecular weight of 238.28 g/mol, XLogP of 2.69, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-bis(methoxymethoxy)-4-[(E)-prop-1-enyl]benzene is sourced from PubChem (CID 58923294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).