1-methoxy-2-[2-methoxyethoxy(methyl)phosphoryl]oxyethane

C7H17O5P — CID 547065

IUPAC1-methoxy-2-[2-methoxyethoxy(methyl)phosphoryl]oxyethane
SMILESCOCCOP(C)(=O)OCCOC
InChIInChI=1S/C7H17O5P/c1-9-4-6-11-13(3,8)12-7-5-10-2/h4-7H2,1-3H3
InChIKeyHAWPIZIMCDPZGJ-UHFFFAOYSA-N
MW212.18 g/mol
LogP1.14
Rot. Bonds8

About 1-methoxy-2-[2-methoxyethoxy(methyl)phosphoryl]oxyethane

1-methoxy-2-[2-methoxyethoxy(methyl)phosphoryl]oxyethane (PubChem CID 547065) has the molecular formula C7H17O5P and a molecular weight of 212.18 g/mol. Its IUPAC name is 1-methoxy-2-[2-methoxyethoxy(methyl)phosphoryl]oxyethane.

Molecular Properties

Compound Name1-methoxy-2-[2-methoxyethoxy(methyl)phosphoryl]oxyethane
PubChem CID547065
Molecular FormulaC7H17O5P
Molecular Weight212.18 g/mol
Exact Mass212.08
IUPAC Name1-methoxy-2-[2-methoxyethoxy(methyl)phosphoryl]oxyethane
SMILESCOCCOP(C)(=O)OCCOC
InChIInChI=1S/C7H17O5P/c1-9-4-6-11-13(3,8)12-7-5-10-2/h4-7H2,1-3H3
InChIKeyHAWPIZIMCDPZGJ-UHFFFAOYSA-N
XLogP1.14
TPSA53.99 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.18
LogP ≤ 51.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-methoxy-2-[2-methoxyethoxy(methyl)phosphoryl]oxyethane?
The IUPAC name of 1-methoxy-2-[2-methoxyethoxy(methyl)phosphoryl]oxyethane (CID 547065) is 1-methoxy-2-[2-methoxyethoxy(methyl)phosphoryl]oxyethane.
What is the SMILES notation for 1-methoxy-2-[2-methoxyethoxy(methyl)phosphoryl]oxyethane?
The canonical SMILES for 1-methoxy-2-[2-methoxyethoxy(methyl)phosphoryl]oxyethane is COCCOP(C)(=O)OCCOC.
What is the InChIKey of 1-methoxy-2-[2-methoxyethoxy(methyl)phosphoryl]oxyethane?
The InChIKey is HAWPIZIMCDPZGJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H17O5P/c1-9-4-6-11-13(3,8)12-7-5-10-2/h4-7H2,1-3H3.
What are the key properties of 1-methoxy-2-[2-methoxyethoxy(methyl)phosphoryl]oxyethane?
1-methoxy-2-[2-methoxyethoxy(methyl)phosphoryl]oxyethane has a molecular weight of 212.18 g/mol, XLogP of 1.14, 8 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-2-[2-methoxyethoxy(methyl)phosphoryl]oxyethane is sourced from PubChem (CID 547065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).