2-methyl-3-prop-2-enoxy-2-(prop-2-enoxymethyl)propan-1-ol

C11H20O3 — CID 10074994

IUPAC2-methyl-3-prop-2-enoxy-2-(prop-2-enoxymethyl)propan-1-ol
SMILESC=CCOCC(C)(CO)COCC=C
InChIInChI=1S/C11H20O3/c1-4-6-13-9-11(3,8-12)10-14-7-5-2/h4-5,12H,1-2,6-10H2,3H3
InChIKeyFZDWPKYSPYIDKL-UHFFFAOYSA-N
MW200.28 g/mol
LogP1.39
Rot. Bonds9

About 2-methyl-3-prop-2-enoxy-2-(prop-2-enoxymethyl)propan-1-ol

2-methyl-3-prop-2-enoxy-2-(prop-2-enoxymethyl)propan-1-ol (PubChem CID 10074994) has the molecular formula C11H20O3 and a molecular weight of 200.28 g/mol. Its IUPAC name is 2-methyl-3-prop-2-enoxy-2-(prop-2-enoxymethyl)propan-1-ol.

Molecular Properties

Compound Name2-methyl-3-prop-2-enoxy-2-(prop-2-enoxymethyl)propan-1-ol
PubChem CID10074994
Molecular FormulaC11H20O3
Molecular Weight200.28 g/mol
Exact Mass200.14
IUPAC Name2-methyl-3-prop-2-enoxy-2-(prop-2-enoxymethyl)propan-1-ol
SMILESC=CCOCC(C)(CO)COCC=C
InChIInChI=1S/C11H20O3/c1-4-6-13-9-11(3,8-12)10-14-7-5-2/h4-5,12H,1-2,6-10H2,3H3
InChIKeyFZDWPKYSPYIDKL-UHFFFAOYSA-N
XLogP1.39
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 51.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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

Trimethylolpropane diallyl ether
CID 61196
3-(Allyloxy)-2,2-bis((allyloxy)methyl)propanol
CID 73854
Trimethylolpropane monoallyl ether
CID 12683
3-(2-Propen-1-yloxy)-1-propanol
CID 165762
Allyl pentaerythritol
CID 3086330
Diallyl pentaerythritol
CID 13955027
Allyl ether pentaerythritol
CID 21951179
2-((Allyloxy)methyl)-2-methylpropane-1,3-diol
CID 11116339
3-{2,2-Dimethyl-3-[(prop-2-en-1-yl)oxy]propoxy}prop-1-ene
CID 57118882
2-(Fluoromethyl)-2-methyl-3-prop-2-enoxypropan-1-ol
CID 156033113
2,2-Dimethyl-3-[(prop-2-en-1-yl)oxy]propan-1-ol
CID 12663604
3-(3-Methylbut-2-enoxy)propan-1-ol
CID 14431843

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-prop-2-enoxy-2-(prop-2-enoxymethyl)propan-1-ol?
The IUPAC name of 2-methyl-3-prop-2-enoxy-2-(prop-2-enoxymethyl)propan-1-ol (CID 10074994) is 2-methyl-3-prop-2-enoxy-2-(prop-2-enoxymethyl)propan-1-ol.
What is the SMILES notation for 2-methyl-3-prop-2-enoxy-2-(prop-2-enoxymethyl)propan-1-ol?
The canonical SMILES for 2-methyl-3-prop-2-enoxy-2-(prop-2-enoxymethyl)propan-1-ol is C=CCOCC(C)(CO)COCC=C.
What is the InChIKey of 2-methyl-3-prop-2-enoxy-2-(prop-2-enoxymethyl)propan-1-ol?
The InChIKey is FZDWPKYSPYIDKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O3/c1-4-6-13-9-11(3,8-12)10-14-7-5-2/h4-5,12H,1-2,6-10H2,3H3.
What are the key properties of 2-methyl-3-prop-2-enoxy-2-(prop-2-enoxymethyl)propan-1-ol?
2-methyl-3-prop-2-enoxy-2-(prop-2-enoxymethyl)propan-1-ol has a molecular weight of 200.28 g/mol, XLogP of 1.39, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-prop-2-enoxy-2-(prop-2-enoxymethyl)propan-1-ol is sourced from PubChem (CID 10074994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).