2-(2-butoxyethoxy)ethanol;ethane-1,2-diol

C10H24O5 — CID 18459544

IUPAC2-(2-butoxyethoxy)ethanol;ethane-1,2-diol
SMILESCCCCOCCOCCO.OCCO
InChIInChI=1S/C8H18O3.C2H6O2/c1-2-3-5-10-7-8-11-6-4-9;3-1-2-4/h9H,2-8H2,1H3;3-4H,1-2H2
InChIKeySLRGUNAXADUGIE-UHFFFAOYSA-N
MW224.30 g/mol
LogP-0.22
Rot. Bonds9

About 2-(2-butoxyethoxy)ethanol;ethane-1,2-diol

2-(2-butoxyethoxy)ethanol;ethane-1,2-diol (PubChem CID 18459544) has the molecular formula C10H24O5 and a molecular weight of 224.30 g/mol. Its IUPAC name is 2-(2-butoxyethoxy)ethanol;ethane-1,2-diol.

Molecular Properties

Compound Name2-(2-butoxyethoxy)ethanol;ethane-1,2-diol
PubChem CID18459544
Molecular FormulaC10H24O5
Molecular Weight224.30 g/mol
Exact Mass224.16
IUPAC Name2-(2-butoxyethoxy)ethanol;ethane-1,2-diol
SMILESCCCCOCCOCCO.OCCO
InChIInChI=1S/C8H18O3.C2H6O2/c1-2-3-5-10-7-8-11-6-4-9;3-1-2-4/h9H,2-8H2,1H3;3-4H,1-2H2
InChIKeySLRGUNAXADUGIE-UHFFFAOYSA-N
XLogP-0.22
TPSA79.15 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 5-0.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-(2-butoxyethoxy)ethanol;ethane-1,2-diol;2-(2-hydroxyethoxy)ethanol;2-[2-(2-hydroxyethoxy)ethoxy]ethanol
CID 174801063
2-butoxyethanol
CID 8133
2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethanol;1-propoxybutane
CID 175100397
2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethanol;1-propoxybutane
CID 175351747
1-butoxybutane;1-ethoxy-2-(2-ethoxyethoxy)ethane;2-(2-hydroxyethoxy)ethanol
CID 118657939
2-butoxyethanol;molecular nitrogen
CID 86737982
2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethanol;1-nonoxynonane
CID 22211981
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-pentadecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 139597034
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-tridecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 139595918
2-[2-[2-[2-[2-[2-[2-[2-[2-(2-heptadecoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 15607546
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-octoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 139594676
ethane-1,2-diol;2-octoxyethanol
CID 87517178

Frequently Asked Questions

What is the IUPAC name of 2-(2-butoxyethoxy)ethanol;ethane-1,2-diol?
The IUPAC name of 2-(2-butoxyethoxy)ethanol;ethane-1,2-diol (CID 18459544) is 2-(2-butoxyethoxy)ethanol;ethane-1,2-diol.
What is the SMILES notation for 2-(2-butoxyethoxy)ethanol;ethane-1,2-diol?
The canonical SMILES for 2-(2-butoxyethoxy)ethanol;ethane-1,2-diol is CCCCOCCOCCO.OCCO.
What is the InChIKey of 2-(2-butoxyethoxy)ethanol;ethane-1,2-diol?
The InChIKey is SLRGUNAXADUGIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18O3.C2H6O2/c1-2-3-5-10-7-8-11-6-4-9;3-1-2-4/h9H,2-8H2,1H3;3-4H,1-2H2.
What are the key properties of 2-(2-butoxyethoxy)ethanol;ethane-1,2-diol?
2-(2-butoxyethoxy)ethanol;ethane-1,2-diol has a molecular weight of 224.30 g/mol, XLogP of -0.22, 9 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-butoxyethoxy)ethanol;ethane-1,2-diol is sourced from PubChem (CID 18459544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).