3-(ethenoxymethoxy)-2,2-bis(ethenoxymethoxymethyl)propan-1-ol

C14H24O7 — CID 23397907

IUPAC3-(ethenoxymethoxy)-2,2-bis(ethenoxymethoxymethyl)propan-1-ol
SMILESC=COCOCC(CO)(COCOC=C)COCOC=C
InChIInChI=1S/C14H24O7/c1-4-16-11-19-8-14(7-15,9-20-12-17-5-2)10-21-13-18-6-3/h4-6,15H,1-3,7-13H2
InChIKeyUWEUVYMNQVWSTL-UHFFFAOYSA-N
MW304.34 g/mol
LogP1.37
Rot. Bonds16

About 3-(ethenoxymethoxy)-2,2-bis(ethenoxymethoxymethyl)propan-1-ol

3-(ethenoxymethoxy)-2,2-bis(ethenoxymethoxymethyl)propan-1-ol (PubChem CID 23397907) has the molecular formula C14H24O7 and a molecular weight of 304.34 g/mol. Its IUPAC name is 3-(ethenoxymethoxy)-2,2-bis(ethenoxymethoxymethyl)propan-1-ol.

Molecular Properties

Compound Name3-(ethenoxymethoxy)-2,2-bis(ethenoxymethoxymethyl)propan-1-ol
PubChem CID23397907
Molecular FormulaC14H24O7
Molecular Weight304.34 g/mol
Exact Mass304.15
IUPAC Name3-(ethenoxymethoxy)-2,2-bis(ethenoxymethoxymethyl)propan-1-ol
SMILESC=COCOCC(CO)(COCOC=C)COCOC=C
InChIInChI=1S/C14H24O7/c1-4-16-11-19-8-14(7-15,9-20-12-17-5-2)10-21-13-18-6-3/h4-6,15H,1-3,7-13H2
InChIKeyUWEUVYMNQVWSTL-UHFFFAOYSA-N
XLogP1.37
TPSA75.61 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds16
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.34
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-(ethenoxymethoxy)-2,2-bis(ethenoxymethoxymethyl)propan-1-ol?
The IUPAC name of 3-(ethenoxymethoxy)-2,2-bis(ethenoxymethoxymethyl)propan-1-ol (CID 23397907) is 3-(ethenoxymethoxy)-2,2-bis(ethenoxymethoxymethyl)propan-1-ol.
What is the SMILES notation for 3-(ethenoxymethoxy)-2,2-bis(ethenoxymethoxymethyl)propan-1-ol?
The canonical SMILES for 3-(ethenoxymethoxy)-2,2-bis(ethenoxymethoxymethyl)propan-1-ol is C=COCOCC(CO)(COCOC=C)COCOC=C.
What is the InChIKey of 3-(ethenoxymethoxy)-2,2-bis(ethenoxymethoxymethyl)propan-1-ol?
The InChIKey is UWEUVYMNQVWSTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24O7/c1-4-16-11-19-8-14(7-15,9-20-12-17-5-2)10-21-13-18-6-3/h4-6,15H,1-3,7-13H2.
What are the key properties of 3-(ethenoxymethoxy)-2,2-bis(ethenoxymethoxymethyl)propan-1-ol?
3-(ethenoxymethoxy)-2,2-bis(ethenoxymethoxymethyl)propan-1-ol has a molecular weight of 304.34 g/mol, XLogP of 1.37, 16 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(ethenoxymethoxy)-2,2-bis(ethenoxymethoxymethyl)propan-1-ol is sourced from PubChem (CID 23397907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).