1-[2-(1-methoxypropan-2-yloxy)ethoxy]propan-2-ol

C9H20O4 — CID 18709988

IUPAC1-[2-(1-methoxypropan-2-yloxy)ethoxy]propan-2-ol
SMILESCOCC(C)OCCOCC(C)O
InChIInChI=1S/C9H20O4/c1-8(10)6-12-4-5-13-9(2)7-11-3/h8-10H,4-7H2,1-3H3
InChIKeyMWRROAAJTCTLBH-UHFFFAOYSA-N
MW192.25 g/mol
LogP0.44
Rot. Bonds8

About 1-[2-(1-methoxypropan-2-yloxy)ethoxy]propan-2-ol

1-[2-(1-methoxypropan-2-yloxy)ethoxy]propan-2-ol (PubChem CID 18709988) has the molecular formula C9H20O4 and a molecular weight of 192.25 g/mol. Its IUPAC name is 1-[2-(1-methoxypropan-2-yloxy)ethoxy]propan-2-ol.

Molecular Properties

Compound Name1-[2-(1-methoxypropan-2-yloxy)ethoxy]propan-2-ol
PubChem CID18709988
Molecular FormulaC9H20O4
Molecular Weight192.25 g/mol
Exact Mass192.14
IUPAC Name1-[2-(1-methoxypropan-2-yloxy)ethoxy]propan-2-ol
SMILESCOCC(C)OCCOCC(C)O
InChIInChI=1S/C9H20O4/c1-8(10)6-12-4-5-13-9(2)7-11-3/h8-10H,4-7H2,1-3H3
InChIKeyMWRROAAJTCTLBH-UHFFFAOYSA-N
XLogP0.44
TPSA47.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.25
LogP ≤ 50.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-[2-[2-[1-(2-methoxypropoxy)propan-2-yloxy]ethoxy]propoxy]propan-2-ol
CID 122545429
2-[2-(2-hydroxyethoxy)ethoxy]ethanol;1-[1-(1-methoxypropan-2-yloxy)propan-2-yloxy]propan-2-ol
CID 22051748
1-[2-[4-[2-(2-hydroxypropoxy)propoxy]butoxy]ethoxy]propan-2-ol
CID 163521633
1-(1-butoxypropan-2-yloxy)propan-2-ol;1-(1-methoxypropan-2-yloxy)propan-2-ol
CID 88546913
2-[2-[2-(1-methoxypropan-2-yloxy)ethoxy]ethoxy]ethanethiol
CID 172538791
(2S)-1-[2-(3-methoxypropoxy)ethoxy]propan-2-ol
CID 103179631
3-(2-hydroxypropoxy)propane-1,1-diol
CID 88599165
1-methoxypropan-2-ol chloride
CID 23303898
1-methoxy-3-(1-methoxypropan-2-yloxy)propan-2-ol
CID 107508429
1-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]propan-2-ol
CID 86587580
2-(2-hydroxyethoxy)ethanol;1-[2-(2-hydroxyethoxy)ethoxy]propan-2-ol
CID 161004910
1-[1-[1-(1-methoxypropan-2-yloxy)propan-2-yloxy]propan-2-yloxy]butan-2-ol
CID 20834285

Frequently Asked Questions

What is the IUPAC name of 1-[2-(1-methoxypropan-2-yloxy)ethoxy]propan-2-ol?
The IUPAC name of 1-[2-(1-methoxypropan-2-yloxy)ethoxy]propan-2-ol (CID 18709988) is 1-[2-(1-methoxypropan-2-yloxy)ethoxy]propan-2-ol.
What is the SMILES notation for 1-[2-(1-methoxypropan-2-yloxy)ethoxy]propan-2-ol?
The canonical SMILES for 1-[2-(1-methoxypropan-2-yloxy)ethoxy]propan-2-ol is COCC(C)OCCOCC(C)O.
What is the InChIKey of 1-[2-(1-methoxypropan-2-yloxy)ethoxy]propan-2-ol?
The InChIKey is MWRROAAJTCTLBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H20O4/c1-8(10)6-12-4-5-13-9(2)7-11-3/h8-10H,4-7H2,1-3H3.
What are the key properties of 1-[2-(1-methoxypropan-2-yloxy)ethoxy]propan-2-ol?
1-[2-(1-methoxypropan-2-yloxy)ethoxy]propan-2-ol has a molecular weight of 192.25 g/mol, XLogP of 0.44, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(1-methoxypropan-2-yloxy)ethoxy]propan-2-ol is sourced from PubChem (CID 18709988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).