2-[2-[2-[2-(8-methyldecoxy)ethoxy]ethoxy]ethoxy]ethanol

C19H40O5 — CID 176653038

IUPAC2-[2-[2-[2-(8-methyldecoxy)ethoxy]ethoxy]ethoxy]ethanol
SMILESCCC(C)CCCCCCCOCCOCCOCCOCCO
InChIInChI=1S/C19H40O5/c1-3-19(2)9-7-5-4-6-8-11-21-13-15-23-17-18-24-16-14-22-12-10-20/h19-20H,3-18H2,1-2H3
InChIKeyUSVYCCIGACDBKP-UHFFFAOYSA-N
MW348.52 g/mol
LogP3.43
Rot. Bonds20

About 2-[2-[2-[2-(8-methyldecoxy)ethoxy]ethoxy]ethoxy]ethanol

2-[2-[2-[2-(8-methyldecoxy)ethoxy]ethoxy]ethoxy]ethanol (PubChem CID 176653038) has the molecular formula C19H40O5 and a molecular weight of 348.52 g/mol. Its IUPAC name is 2-[2-[2-[2-(8-methyldecoxy)ethoxy]ethoxy]ethoxy]ethanol.

Molecular Properties

Compound Name2-[2-[2-[2-(8-methyldecoxy)ethoxy]ethoxy]ethoxy]ethanol
PubChem CID176653038
Molecular FormulaC19H40O5
Molecular Weight348.52 g/mol
Exact Mass348.29
IUPAC Name2-[2-[2-[2-(8-methyldecoxy)ethoxy]ethoxy]ethoxy]ethanol
SMILESCCC(C)CCCCCCCOCCOCCOCCOCCO
InChIInChI=1S/C19H40O5/c1-3-19(2)9-7-5-4-6-8-11-21-13-15-23-17-18-24-16-14-22-12-10-20/h19-20H,3-18H2,1-2H3
InChIKeyUSVYCCIGACDBKP-UHFFFAOYSA-N
XLogP3.43
TPSA57.15 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds20
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.52
LogP ≤ 53.43
H-Bond Donors ≤ 51
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-[2-(5-methylheptoxy)ethoxy]ethoxy]ethanol
CID 176653191
3-(14-methylhexadecoxy)propan-1-ol
CID 59379115
2-[2-(7-ethylnonoxy)ethoxy]ethanol
CID 176653244
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(8-methylnonoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 139989592
2-[2-[2-[2-[2-(6-methylheptoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 87339200
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(11-methyldodecoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 100929205
2-[2-[2-(2-methylundecoxy)ethoxy]ethoxy]ethanol
CID 59203503
2-[2-[2-[2-[2-(3-methylnonoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 176653158
2-(7-methylnonoxy)ethanamine
CID 90169866
2-[2-[2-[2-(7-ethyldecoxy)ethoxy]ethoxy]ethoxy]ethanol
CID 176652982
1-dodecoxydodecane;3-methylheptane
CID 174412934
(7S)-7-methylnonan-1-ol
CID 11105641

Frequently Asked Questions

What is the IUPAC name of 2-[2-[2-[2-(8-methyldecoxy)ethoxy]ethoxy]ethoxy]ethanol?
The IUPAC name of 2-[2-[2-[2-(8-methyldecoxy)ethoxy]ethoxy]ethoxy]ethanol (CID 176653038) is 2-[2-[2-[2-(8-methyldecoxy)ethoxy]ethoxy]ethoxy]ethanol.
What is the SMILES notation for 2-[2-[2-[2-(8-methyldecoxy)ethoxy]ethoxy]ethoxy]ethanol?
The canonical SMILES for 2-[2-[2-[2-(8-methyldecoxy)ethoxy]ethoxy]ethoxy]ethanol is CCC(C)CCCCCCCOCCOCCOCCOCCO.
What is the InChIKey of 2-[2-[2-[2-(8-methyldecoxy)ethoxy]ethoxy]ethoxy]ethanol?
The InChIKey is USVYCCIGACDBKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H40O5/c1-3-19(2)9-7-5-4-6-8-11-21-13-15-23-17-18-24-16-14-22-12-10-20/h19-20H,3-18H2,1-2H3.
What are the key properties of 2-[2-[2-[2-(8-methyldecoxy)ethoxy]ethoxy]ethoxy]ethanol?
2-[2-[2-[2-(8-methyldecoxy)ethoxy]ethoxy]ethoxy]ethanol has a molecular weight of 348.52 g/mol, XLogP of 3.43, 20 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[2-[2-(8-methyldecoxy)ethoxy]ethoxy]ethoxy]ethanol is sourced from PubChem (CID 176653038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).