1-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propan-2-ol

C13H28O7 — CID 86587580

IUPAC1-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propan-2-ol
SMILESCC(O)COCCOCCOCCOCCOCCO
InChIInChI=1S/C13H28O7/c1-13(15)12-20-11-10-19-9-8-18-7-6-17-5-4-16-3-2-14/h13-15H,2-12H2,1H3
InChIKeyDNZFFDAMYHOZRX-UHFFFAOYSA-N
MW296.36 g/mol
LogP-0.56
Rot. Bonds16

About 1-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propan-2-ol

1-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propan-2-ol (PubChem CID 86587580) has the molecular formula C13H28O7 and a molecular weight of 296.36 g/mol. Its IUPAC name is 1-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propan-2-ol.

Molecular Properties

Compound Name1-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propan-2-ol
PubChem CID86587580
Molecular FormulaC13H28O7
Molecular Weight296.36 g/mol
Exact Mass296.18
IUPAC Name1-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propan-2-ol
SMILESCC(O)COCCOCCOCCOCCOCCO
InChIInChI=1S/C13H28O7/c1-13(15)12-20-11-10-19-9-8-18-7-6-17-5-4-16-3-2-14/h13-15H,2-12H2,1H3
InChIKeyDNZFFDAMYHOZRX-UHFFFAOYSA-N
XLogP-0.56
TPSA86.61 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds16
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.36
LogP ≤ 5-0.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Related Compounds

2-(2-hydroxyethoxy)ethanol;1-[2-(2-hydroxyethoxy)ethoxy]propan-2-ol
CID 161004910
1-(2-hydroxyethoxy)propan-2-ol
CID 19360868
but-2-enedioic acid;1-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propan-2-ol
CID 163538655
2-[2-[2-[2-[2-[2-(2-methylpropoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 6428225
2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-1-sulfanylethanol
CID 178070711
1-ethoxypropan-2-ol;2-(2-ethylbutoxy)ethanol
CID 159420422
2-[2-(2-hydroxyethoxy)ethoxy]ethanol;1-[1-(1-methoxypropan-2-yloxy)propan-2-yloxy]propan-2-ol
CID 22051748
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol;2-[2-(2-hydroxypropoxy)propoxy]propan-1-ol
CID 22918050
ethane-1,2-diol;2-[2-(2-hydroxyethoxy)ethoxy]ethanol;propane-1,2-diol;propane-1,3-diol
CID 161458726
1-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]-3-methoxypropan-2-ol
CID 88655335
5-(2-hydroxypropoxy)pentan-1-ol
CID 14473456
1-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]-5-methylhexan-2-ol
CID 140523651

Frequently Asked Questions

What is the IUPAC name of 1-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propan-2-ol?
The IUPAC name of 1-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propan-2-ol (CID 86587580) is 1-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propan-2-ol.
What is the SMILES notation for 1-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propan-2-ol?
The canonical SMILES for 1-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propan-2-ol is CC(O)COCCOCCOCCOCCOCCO.
What is the InChIKey of 1-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propan-2-ol?
The InChIKey is DNZFFDAMYHOZRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28O7/c1-13(15)12-20-11-10-19-9-8-18-7-6-17-5-4-16-3-2-14/h13-15H,2-12H2,1H3.
What are the key properties of 1-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propan-2-ol?
1-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propan-2-ol has a molecular weight of 296.36 g/mol, XLogP of -0.56, 16 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propan-2-ol is sourced from PubChem (CID 86587580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).