1-(2-methylbutan-2-yloxy)tetradecane

C19H40O — CID 86191698

IUPAC1-(2-methylbutan-2-yloxy)tetradecane
SMILESCCCCCCCCCCCCCCOC(C)(C)CC
InChIInChI=1S/C19H40O/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-20-19(3,4)6-2/h5-18H2,1-4H3
InChIKeyGHPCTINGHJMNGA-UHFFFAOYSA-N
MW284.53 g/mol
LogP6.89
Rot. Bonds15

About 1-(2-methylbutan-2-yloxy)tetradecane

1-(2-methylbutan-2-yloxy)tetradecane (PubChem CID 86191698) has the molecular formula C19H40O and a molecular weight of 284.53 g/mol. Its IUPAC name is 1-(2-methylbutan-2-yloxy)tetradecane.

Molecular Properties

Compound Name1-(2-methylbutan-2-yloxy)tetradecane
PubChem CID86191698
Molecular FormulaC19H40O
Molecular Weight284.53 g/mol
Exact Mass284.31
IUPAC Name1-(2-methylbutan-2-yloxy)tetradecane
SMILESCCCCCCCCCCCCCCOC(C)(C)CC
InChIInChI=1S/C19H40O/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-20-19(3,4)6-2/h5-18H2,1-4H3
InChIKeyGHPCTINGHJMNGA-UHFFFAOYSA-N
XLogP6.89
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds15
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500284.53
LogP ≤ 56.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1,10-bis(2-methylbutan-2-yloxy)decane
CID 171725385
2-dodecoxy-2-methyltetradecane
CID 158074564
N-[2-(2-methylbutan-2-yloxy)ethyl]pentan-1-amine
CID 62597960
dodecane;2-methyl-2-(2-methylbutan-2-ylperoxy)butane
CID 159573008
lithium;hydride;1-[(2-methylpropan-2-yl)oxy]octane
CID 174475120
azane;2-dodecoxypropan-2-ol
CID 87960511
9-heptoxy-9-methylhenicosane
CID 91127088
N-ethyl-2-hexoxy-2-methylbutan-1-amine
CID 62354032
2-decoxy-2-methylbutan-1-ol
CID 152517276
1-(trichloromethoxy)hexane
CID 87956638
1-(2,3-dimethylbutan-2-yloxy)decane
CID 172756117
2-methyl-2-nonadecoxybutanoic acid
CID 88680932

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylbutan-2-yloxy)tetradecane?
The IUPAC name of 1-(2-methylbutan-2-yloxy)tetradecane (CID 86191698) is 1-(2-methylbutan-2-yloxy)tetradecane.
What is the SMILES notation for 1-(2-methylbutan-2-yloxy)tetradecane?
The canonical SMILES for 1-(2-methylbutan-2-yloxy)tetradecane is CCCCCCCCCCCCCCOC(C)(C)CC.
What is the InChIKey of 1-(2-methylbutan-2-yloxy)tetradecane?
The InChIKey is GHPCTINGHJMNGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H40O/c1-5-7-8-9-10-11-12-13-14-15-16-17-18-20-19(3,4)6-2/h5-18H2,1-4H3.
What are the key properties of 1-(2-methylbutan-2-yloxy)tetradecane?
1-(2-methylbutan-2-yloxy)tetradecane has a molecular weight of 284.53 g/mol, XLogP of 6.89, 15 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylbutan-2-yloxy)tetradecane is sourced from PubChem (CID 86191698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).