10,10-dimethyl-1-(2-methylpropoxy)undecane

C17H36O — CID 151746454

IUPAC10,10-dimethyl-1-(2-methylpropoxy)undecane
SMILESCC(C)COCCCCCCCCCC(C)(C)C
InChIInChI=1S/C17H36O/c1-16(2)15-18-14-12-10-8-6-7-9-11-13-17(3,4)5/h16H,6-15H2,1-5H3
InChIKeyRNPVBDXOSGCYPM-UHFFFAOYSA-N
MW256.47 g/mol
LogP5.83
Rot. Bonds11

About 10,10-dimethyl-1-(2-methylpropoxy)undecane

10,10-dimethyl-1-(2-methylpropoxy)undecane (PubChem CID 151746454) has the molecular formula C17H36O and a molecular weight of 256.47 g/mol. Its IUPAC name is 10,10-dimethyl-1-(2-methylpropoxy)undecane.

Molecular Properties

Compound Name10,10-dimethyl-1-(2-methylpropoxy)undecane
PubChem CID151746454
Molecular FormulaC17H36O
Molecular Weight256.47 g/mol
Exact Mass256.28
IUPAC Name10,10-dimethyl-1-(2-methylpropoxy)undecane
SMILESCC(C)COCCCCCCCCCC(C)(C)C
InChIInChI=1S/C17H36O/c1-16(2)15-18-14-12-10-8-6-7-9-11-13-17(3,4)5/h16H,6-15H2,1-5H3
InChIKeyRNPVBDXOSGCYPM-UHFFFAOYSA-N
XLogP5.83
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500256.47
LogP ≤ 55.83
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-[(2-methylpropan-2-yl)oxy]-8-(2-methylpropoxy)octane
CID 173256840
1-(3,7-dimethyloctoxy)-10,10-dimethylundecane
CID 139372229
3,3-dimethyl-1-[2-[2-[2-(2-methylpropoxy)ethoxy]ethoxy]ethoxy]butane
CID 167646530
1-[5-(4,4-dimethylpentoxy)pentoxy]-4,4-dimethylpentane
CID 158699807
1-[(2-methylpropan-2-yl)oxy]-4-(2-methylpropoxy)butane
CID 139316790
2-methyl-1-[3-(2-methylpropoxy)propoxy]propane
CID 22020669
1-amino-2-[2-[2-[2-(10,10-dimethylundecoxy)ethoxy]ethoxy]ethoxy]ethanol
CID 101137569
7-methyl-1-(2-methylpropoxy)octane
CID 23222552
1-ethoxy-10,10-dimethylundecane
CID 150524219
6-methyl-1-(2-methylpropoxy)heptane
CID 58371735
1-(2-methylpropoxy)tridecane
CID 91526471
1-(2-methylpropoxy)undecane
CID 58527571

Frequently Asked Questions

What is the IUPAC name of 10,10-dimethyl-1-(2-methylpropoxy)undecane?
The IUPAC name of 10,10-dimethyl-1-(2-methylpropoxy)undecane (CID 151746454) is 10,10-dimethyl-1-(2-methylpropoxy)undecane.
What is the SMILES notation for 10,10-dimethyl-1-(2-methylpropoxy)undecane?
The canonical SMILES for 10,10-dimethyl-1-(2-methylpropoxy)undecane is CC(C)COCCCCCCCCCC(C)(C)C.
What is the InChIKey of 10,10-dimethyl-1-(2-methylpropoxy)undecane?
The InChIKey is RNPVBDXOSGCYPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H36O/c1-16(2)15-18-14-12-10-8-6-7-9-11-13-17(3,4)5/h16H,6-15H2,1-5H3.
What are the key properties of 10,10-dimethyl-1-(2-methylpropoxy)undecane?
10,10-dimethyl-1-(2-methylpropoxy)undecane has a molecular weight of 256.47 g/mol, XLogP of 5.83, 11 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 10,10-dimethyl-1-(2-methylpropoxy)undecane is sourced from PubChem (CID 151746454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).