2-[2-(2-ethoxypropoxy)propoxy]propan-1-ol;2-[2-(2-methoxypropoxy)propoxy]propan-1-ol

C21H46O8 — CID 160742251

IUPAC2-[2-(2-ethoxypropoxy)propoxy]propan-1-ol;2-[2-(2-methoxypropoxy)propoxy]propan-1-ol
SMILESCCOC(C)COC(C)COC(C)CO.COC(C)COC(C)COC(C)CO
InChIInChI=1S/C11H24O4.C10H22O4/c1-5-13-10(3)7-15-11(4)8-14-9(2)6-12;1-8(5-11)13-7-10(3)14-6-9(2)12-4/h9-12H,5-8H2,1-4H3;8-11H,5-7H2,1-4H3
InChIKeyRVSVFBVAJCZOKW-UHFFFAOYSA-N
MW426.59 g/mol
LogP2.04
Rot. Bonds17

About 2-[2-(2-ethoxypropoxy)propoxy]propan-1-ol;2-[2-(2-methoxypropoxy)propoxy]propan-1-ol

2-[2-(2-ethoxypropoxy)propoxy]propan-1-ol;2-[2-(2-methoxypropoxy)propoxy]propan-1-ol (PubChem CID 160742251) has the molecular formula C21H46O8 and a molecular weight of 426.59 g/mol. Its IUPAC name is 2-[2-(2-ethoxypropoxy)propoxy]propan-1-ol;2-[2-(2-methoxypropoxy)propoxy]propan-1-ol.

Molecular Properties

Compound Name2-[2-(2-ethoxypropoxy)propoxy]propan-1-ol;2-[2-(2-methoxypropoxy)propoxy]propan-1-ol
PubChem CID160742251
Molecular FormulaC21H46O8
Molecular Weight426.59 g/mol
Exact Mass426.32
IUPAC Name2-[2-(2-ethoxypropoxy)propoxy]propan-1-ol;2-[2-(2-methoxypropoxy)propoxy]propan-1-ol
SMILESCCOC(C)COC(C)COC(C)CO.COC(C)COC(C)COC(C)CO
InChIInChI=1S/C11H24O4.C10H22O4/c1-5-13-10(3)7-15-11(4)8-14-9(2)6-12;1-8(5-11)13-7-10(3)14-6-9(2)12-4/h9-12H,5-8H2,1-4H3;8-11H,5-7H2,1-4H3
InChIKeyRVSVFBVAJCZOKW-UHFFFAOYSA-N
XLogP2.04
TPSA95.84 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds17
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500426.59
LogP ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze 2-[2-(2-ethoxypropoxy)propoxy]propan-1-ol;2-[2-(2-methoxypropoxy)propoxy]propan-1-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Dipropylene Glycol
CID 134692469
Tripropyleneglycol monomethyl ether
CID 30111
1-Propanol, 2-(2-(2-methoxypropoxy)propoxy)-
CID 25054
Tetrapropylene glycol
CID 91234
Propanol, 1(or 2)-(methyl-2-(methyl-2-propoxyethoxy)ethoxy)-
CID 528429
2,5,8,11,14,17,20,23,26,29-Decaoxahentriacontan-31-ol
CID 14550547
Decaglycerol
CID 111835
3,6,9,12,15,18,21,24-Octaoxapentacosan-1-ol
CID 526558
Undecaethylene glycol monomethyl ether
CID 14433924
3,6,9,12,15,18,21,24,27,30,33-Undecaoxapentatriacontan-1-ol
CID 15622290
2-(2-(2-Methoxy-1-methyl-ethoxy)-1-methyl-ethoxy)propan-1-OL
CID 33023
2-(2-(2-Hydroxypropoxy)propoxy)-1-propanol
CID 32611

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-ethoxypropoxy)propoxy]propan-1-ol;2-[2-(2-methoxypropoxy)propoxy]propan-1-ol?
The IUPAC name of 2-[2-(2-ethoxypropoxy)propoxy]propan-1-ol;2-[2-(2-methoxypropoxy)propoxy]propan-1-ol (CID 160742251) is 2-[2-(2-ethoxypropoxy)propoxy]propan-1-ol;2-[2-(2-methoxypropoxy)propoxy]propan-1-ol.
What is the SMILES notation for 2-[2-(2-ethoxypropoxy)propoxy]propan-1-ol;2-[2-(2-methoxypropoxy)propoxy]propan-1-ol?
The canonical SMILES for 2-[2-(2-ethoxypropoxy)propoxy]propan-1-ol;2-[2-(2-methoxypropoxy)propoxy]propan-1-ol is CCOC(C)COC(C)COC(C)CO.COC(C)COC(C)COC(C)CO.
What is the InChIKey of 2-[2-(2-ethoxypropoxy)propoxy]propan-1-ol;2-[2-(2-methoxypropoxy)propoxy]propan-1-ol?
The InChIKey is RVSVFBVAJCZOKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24O4.C10H22O4/c1-5-13-10(3)7-15-11(4)8-14-9(2)6-12;1-8(5-11)13-7-10(3)14-6-9(2)12-4/h9-12H,5-8H2,1-4H3;8-11H,5-7H2,1-4H3.
What are the key properties of 2-[2-(2-ethoxypropoxy)propoxy]propan-1-ol;2-[2-(2-methoxypropoxy)propoxy]propan-1-ol?
2-[2-(2-ethoxypropoxy)propoxy]propan-1-ol;2-[2-(2-methoxypropoxy)propoxy]propan-1-ol has a molecular weight of 426.59 g/mol, XLogP of 2.04, 17 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-ethoxypropoxy)propoxy]propan-1-ol;2-[2-(2-methoxypropoxy)propoxy]propan-1-ol is sourced from PubChem (CID 160742251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).