2-ethenoxy-2,3-dimethyldecane

C14H28O — CID 19763661

IUPAC2-ethenoxy-2,3-dimethyldecane
SMILESC=COC(C)(C)C(C)CCCCCCC
InChIInChI=1S/C14H28O/c1-6-8-9-10-11-12-13(3)14(4,5)15-7-2/h7,13H,2,6,8-12H2,1,3-5H3
InChIKeyQLYCSLOZBUSGHT-UHFFFAOYSA-N
MW212.38 g/mol
LogP4.92
Rot. Bonds9

About 2-ethenoxy-2,3-dimethyldecane

2-ethenoxy-2,3-dimethyldecane (PubChem CID 19763661) has the molecular formula C14H28O and a molecular weight of 212.38 g/mol. Its IUPAC name is 2-ethenoxy-2,3-dimethyldecane.

Molecular Properties

Compound Name2-ethenoxy-2,3-dimethyldecane
PubChem CID19763661
Molecular FormulaC14H28O
Molecular Weight212.38 g/mol
Exact Mass212.21
IUPAC Name2-ethenoxy-2,3-dimethyldecane
SMILESC=COC(C)(C)C(C)CCCCCCC
InChIInChI=1S/C14H28O/c1-6-8-9-10-11-12-13(3)14(4,5)15-7-2/h7,13H,2,6,8-12H2,1,3-5H3
InChIKeyQLYCSLOZBUSGHT-UHFFFAOYSA-N
XLogP4.92
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.38
LogP ≤ 54.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-ethenoxy-2,3-dimethyldecane?
The IUPAC name of 2-ethenoxy-2,3-dimethyldecane (CID 19763661) is 2-ethenoxy-2,3-dimethyldecane.
What is the SMILES notation for 2-ethenoxy-2,3-dimethyldecane?
The canonical SMILES for 2-ethenoxy-2,3-dimethyldecane is C=COC(C)(C)C(C)CCCCCCC.
What is the InChIKey of 2-ethenoxy-2,3-dimethyldecane?
The InChIKey is QLYCSLOZBUSGHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28O/c1-6-8-9-10-11-12-13(3)14(4,5)15-7-2/h7,13H,2,6,8-12H2,1,3-5H3.
What are the key properties of 2-ethenoxy-2,3-dimethyldecane?
2-ethenoxy-2,3-dimethyldecane has a molecular weight of 212.38 g/mol, XLogP of 4.92, 9 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenoxy-2,3-dimethyldecane is sourced from PubChem (CID 19763661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).