1,2-diethoxyethane;ethene

C10H22O2 — CID 158825770

IUPAC1,2-diethoxyethane;ethene
SMILESC=C.C=C.CCOCCOCC
InChIInChI=1S/C6H14O2.2C2H4/c1-3-7-5-6-8-4-2;2*1-2/h3-6H2,1-2H3;2*1-2H2
InChIKeyIWLASDMHYHOBEV-UHFFFAOYSA-N
MW174.28 g/mol
LogP2.66
Rot. Bonds5

About 1,2-diethoxyethane;ethene

1,2-diethoxyethane;ethene (PubChem CID 158825770) has the molecular formula C10H22O2 and a molecular weight of 174.28 g/mol. Its IUPAC name is 1,2-diethoxyethane;ethene.

Molecular Properties

Compound Name1,2-diethoxyethane;ethene
PubChem CID158825770
Molecular FormulaC10H22O2
Molecular Weight174.28 g/mol
Exact Mass174.16
IUPAC Name1,2-diethoxyethane;ethene
SMILESC=C.C=C.CCOCCOCC
InChIInChI=1S/C6H14O2.2C2H4/c1-3-7-5-6-8-4-2;2*1-2/h3-6H2,1-2H3;2*1-2H2
InChIKeyIWLASDMHYHOBEV-UHFFFAOYSA-N
XLogP2.66
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.28
LogP ≤ 52.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 1,2-diethoxyethane;ethene 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

1,2-diethoxyethane;hydrofluoride
CID 175535770
sodium;1,2-diethoxyethane;hydride
CID 174903036
1,2-diethoxyethane;ethenamine
CID 160675526
1-[2-[2-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propane
CID 88861501
1-ethenoxy-2-ethoxyethane
CID 14510945
bis(1-ethoxy-2-methoxyethane);hydrate
CID 88797439
1,2-diethoxyethane;oxirane
CID 159897663
2-ethoxyethoxyphosphane
CID 153435180
1-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]-2-methoxyethane
CID 19982973
1,2-dimethoxyethane;1-ethoxy-2-(2-ethoxyethoxy)ethane
CID 159445382
CID 101447150
CID 101447150
tris[2-[2-(2-ethoxyethoxy)ethoxy]ethyl]phosphane
CID 141418245

Frequently Asked Questions

What is the IUPAC name of 1,2-diethoxyethane;ethene?
The IUPAC name of 1,2-diethoxyethane;ethene (CID 158825770) is 1,2-diethoxyethane;ethene.
What is the SMILES notation for 1,2-diethoxyethane;ethene?
The canonical SMILES for 1,2-diethoxyethane;ethene is C=C.C=C.CCOCCOCC.
What is the InChIKey of 1,2-diethoxyethane;ethene?
The InChIKey is IWLASDMHYHOBEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14O2.2C2H4/c1-3-7-5-6-8-4-2;2*1-2/h3-6H2,1-2H3;2*1-2H2.
What are the key properties of 1,2-diethoxyethane;ethene?
1,2-diethoxyethane;ethene has a molecular weight of 174.28 g/mol, XLogP of 2.66, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-diethoxyethane;ethene is sourced from PubChem (CID 158825770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).