1-methoxy-2-(2-prop-2-enoxypropoxy)propane

C10H20O3 — CID 20538455

IUPAC1-methoxy-2-(2-prop-2-enoxypropoxy)propane
SMILESC=CCOC(C)COC(C)COC
InChIInChI=1S/C10H20O3/c1-5-6-12-10(3)8-13-9(2)7-11-4/h5,9-10H,1,6-8H2,2-4H3
InChIKeyFXAZTWRLEIGXHV-UHFFFAOYSA-N
MW188.27 g/mol
LogP1.63
Rot. Bonds8

About 1-methoxy-2-(2-prop-2-enoxypropoxy)propane

1-methoxy-2-(2-prop-2-enoxypropoxy)propane (PubChem CID 20538455) has the molecular formula C10H20O3 and a molecular weight of 188.27 g/mol. Its IUPAC name is 1-methoxy-2-(2-prop-2-enoxypropoxy)propane.

Molecular Properties

Compound Name1-methoxy-2-(2-prop-2-enoxypropoxy)propane
PubChem CID20538455
Molecular FormulaC10H20O3
Molecular Weight188.27 g/mol
Exact Mass188.14
IUPAC Name1-methoxy-2-(2-prop-2-enoxypropoxy)propane
SMILESC=CCOC(C)COC(C)COC
InChIInChI=1S/C10H20O3/c1-5-6-12-10(3)8-13-9(2)7-11-4/h5,9-10H,1,6-8H2,2-4H3
InChIKeyFXAZTWRLEIGXHV-UHFFFAOYSA-N
XLogP1.63
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.27
LogP ≤ 51.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-methoxy-2-(2-prop-2-enoxypropoxy)propane?
The IUPAC name of 1-methoxy-2-(2-prop-2-enoxypropoxy)propane (CID 20538455) is 1-methoxy-2-(2-prop-2-enoxypropoxy)propane.
What is the SMILES notation for 1-methoxy-2-(2-prop-2-enoxypropoxy)propane?
The canonical SMILES for 1-methoxy-2-(2-prop-2-enoxypropoxy)propane is C=CCOC(C)COC(C)COC.
What is the InChIKey of 1-methoxy-2-(2-prop-2-enoxypropoxy)propane?
The InChIKey is FXAZTWRLEIGXHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20O3/c1-5-6-12-10(3)8-13-9(2)7-11-4/h5,9-10H,1,6-8H2,2-4H3.
What are the key properties of 1-methoxy-2-(2-prop-2-enoxypropoxy)propane?
1-methoxy-2-(2-prop-2-enoxypropoxy)propane has a molecular weight of 188.27 g/mol, XLogP of 1.63, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methoxy-2-(2-prop-2-enoxypropoxy)propane is sourced from PubChem (CID 20538455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).