9-nonoxynonan-1-ol

C18H38O2 — CID 57318642

IUPAC9-nonoxynonan-1-ol
SMILESCCCCCCCCCOCCCCCCCCCO
InChIInChI=1S/C18H38O2/c1-2-3-4-5-8-11-14-17-20-18-15-12-9-6-7-10-13-16-19/h19H,2-18H2,1H3
InChIKeyARFGJLWUJLRPES-UHFFFAOYSA-N
MW286.50 g/mol
LogP5.48
Rot. Bonds17

About 9-nonoxynonan-1-ol

9-nonoxynonan-1-ol (PubChem CID 57318642) has the molecular formula C18H38O2 and a molecular weight of 286.50 g/mol. Its IUPAC name is 9-nonoxynonan-1-ol.

Molecular Properties

Compound Name9-nonoxynonan-1-ol
PubChem CID57318642
Molecular FormulaC18H38O2
Molecular Weight286.50 g/mol
Exact Mass286.29
IUPAC Name9-nonoxynonan-1-ol
SMILESCCCCCCCCCOCCCCCCCCCO
InChIInChI=1S/C18H38O2/c1-2-3-4-5-8-11-14-17-20-18-15-12-9-6-7-10-13-16-19/h19H,2-18H2,1H3
InChIKeyARFGJLWUJLRPES-UHFFFAOYSA-N
XLogP5.48
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds17
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500286.50
LogP ≤ 55.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

5-octoxypentan-1-ol
CID 22407981
4-[4-(4-pentoxybutoxy)butoxy]butan-1-ol
CID 87472391
1-butoxybutane;hexadecan-1-ol;octadecan-1-ol
CID 174405744
ethane-1,2-diol;1-pentoxyheptane
CID 175114778
2-heptoxyethanol
CID 23889
2-dodecoxyethanol
CID 24750
2-tetradecoxyethanol
CID 16491
2-(2-hydroxyethoxy)ethanol;octan-1-ol
CID 155256848
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-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

Frequently Asked Questions

What is the IUPAC name of 9-nonoxynonan-1-ol?
The IUPAC name of 9-nonoxynonan-1-ol (CID 57318642) is 9-nonoxynonan-1-ol.
What is the SMILES notation for 9-nonoxynonan-1-ol?
The canonical SMILES for 9-nonoxynonan-1-ol is CCCCCCCCCOCCCCCCCCCO.
What is the InChIKey of 9-nonoxynonan-1-ol?
The InChIKey is ARFGJLWUJLRPES-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H38O2/c1-2-3-4-5-8-11-14-17-20-18-15-12-9-6-7-10-13-16-19/h19H,2-18H2,1H3.
What are the key properties of 9-nonoxynonan-1-ol?
9-nonoxynonan-1-ol has a molecular weight of 286.50 g/mol, XLogP of 5.48, 17 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-nonoxynonan-1-ol is sourced from PubChem (CID 57318642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).