1,2-dimethoxyethane;tris(prop-1-ene)

C13H28O2 — CID 159658676

IUPAC1,2-dimethoxyethane;tris(prop-1-ene)
SMILESC=CC.C=CC.C=CC.COCCOC
InChIInChI=1S/C4H10O2.3C3H6/c1-5-3-4-6-2;3*1-3-2/h3-4H2,1-2H3;3*3H,1H2,2H3
InChIKeyMSMUICPPEFAXQQ-UHFFFAOYSA-N
MW216.36 g/mol
LogP3.86
Rot. Bonds3

About 1,2-dimethoxyethane;tris(prop-1-ene)

1,2-dimethoxyethane;tris(prop-1-ene) (PubChem CID 159658676) has the molecular formula C13H28O2 and a molecular weight of 216.36 g/mol. Its IUPAC name is 1,2-dimethoxyethane;tris(prop-1-ene).

Molecular Properties

Compound Name1,2-dimethoxyethane;tris(prop-1-ene)
PubChem CID159658676
Molecular FormulaC13H28O2
Molecular Weight216.36 g/mol
Exact Mass216.21
IUPAC Name1,2-dimethoxyethane;tris(prop-1-ene)
SMILESC=CC.C=CC.C=CC.COCCOC
InChIInChI=1S/C4H10O2.3C3H6/c1-5-3-4-6-2;3*1-3-2/h3-4H2,1-2H3;3*3H,1H2,2H3
InChIKeyMSMUICPPEFAXQQ-UHFFFAOYSA-N
XLogP3.86
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.36
LogP ≤ 53.86
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'}

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Related Compounds

2-methoxyethanol;nonakis(prop-1-ene)
CID 173188725
2-methoxyethylphosphane;prop-1-ene
CID 172678174
2-methoxyethanol;tris(prop-1-ene)
CID 172995123
1-ethenoxy-2-methoxyethane
CID 15457
ethane-1,2-diol;ethene;2-methoxyethanol;tetrakis(prop-1-ene)
CID 173186876
1,2-dimethoxyethane;samarium
CID 174304250
1,2-dimethoxyethane;ethane
CID 91349162
2-methoxyethanol;propan-2-ol;prop-1-ene
CID 87495214
2-methoxyethyl butanoate;tris(prop-1-ene)
CID 173481556
1-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-2-methoxyethane;1-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-2-methoxyethane;1-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-2-methoxyethane;1-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-2-methoxyethane;1-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-2-methoxyethane
CID 158513619
ethoxyethane;2-methoxyethanol;bis(prop-1-ene)
CID 173293108
2-(2-methoxyethoxy)ethanesulfonic acid;prop-1-ene
CID 157374719

Frequently Asked Questions

What is the IUPAC name of 1,2-dimethoxyethane;tris(prop-1-ene)?
The IUPAC name of 1,2-dimethoxyethane;tris(prop-1-ene) (CID 159658676) is 1,2-dimethoxyethane;tris(prop-1-ene).
What is the SMILES notation for 1,2-dimethoxyethane;tris(prop-1-ene)?
The canonical SMILES for 1,2-dimethoxyethane;tris(prop-1-ene) is C=CC.C=CC.C=CC.COCCOC.
What is the InChIKey of 1,2-dimethoxyethane;tris(prop-1-ene)?
The InChIKey is MSMUICPPEFAXQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10O2.3C3H6/c1-5-3-4-6-2;3*1-3-2/h3-4H2,1-2H3;3*3H,1H2,2H3.
What are the key properties of 1,2-dimethoxyethane;tris(prop-1-ene)?
1,2-dimethoxyethane;tris(prop-1-ene) has a molecular weight of 216.36 g/mol, XLogP of 3.86, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dimethoxyethane;tris(prop-1-ene) is sourced from PubChem (CID 159658676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).