1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane;neodymium

C10H22NdO5 — CID 161321430

IUPAC1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane;neodymium
SMILESCOCCOCCOCCOCCOC.[Nd]
InChIInChI=1S/C10H22O5.Nd/c1-11-3-5-13-7-9-15-10-8-14-6-4-12-2;/h3-10H2,1-2H3;
InChIKeyVKESGCDYCOGMBA-UHFFFAOYSA-N
MW366.52 g/mol
LogP0.33
Rot. Bonds12

About 1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane;neodymium

1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane;neodymium (PubChem CID 161321430) has the molecular formula C10H22NdO5 and a molecular weight of 366.52 g/mol. Its IUPAC name is 1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane;neodymium.

Molecular Properties

Compound Name1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane;neodymium
PubChem CID161321430
Molecular FormulaC10H22NdO5
Molecular Weight366.52 g/mol
Exact Mass364.05
IUPAC Name1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane;neodymium
SMILESCOCCOCCOCCOCCOC.[Nd]
InChIInChI=1S/C10H22O5.Nd/c1-11-3-5-13-7-9-15-10-8-14-6-4-12-2;/h3-10H2,1-2H3;
InChIKeyVKESGCDYCOGMBA-UHFFFAOYSA-N
XLogP0.33
TPSA46.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds12
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.52
LogP ≤ 50.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of 1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane;neodymium?
The IUPAC name of 1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane;neodymium (CID 161321430) is 1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane;neodymium.
What is the SMILES notation for 1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane;neodymium?
The canonical SMILES for 1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane;neodymium is COCCOCCOCCOCCOC.[Nd].
What is the InChIKey of 1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane;neodymium?
The InChIKey is VKESGCDYCOGMBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22O5.Nd/c1-11-3-5-13-7-9-15-10-8-14-6-4-12-2;/h3-10H2,1-2H3;.
What are the key properties of 1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane;neodymium?
1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane;neodymium has a molecular weight of 366.52 g/mol, XLogP of 0.33, 12 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane;neodymium is sourced from PubChem (CID 161321430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).