5-(dimethoxymethyl)-5-methylundecane

C15H32O2 — CID 139546819

IUPAC5-(dimethoxymethyl)-5-methylundecane
SMILESCCCCCCC(C)(CCCC)C(OC)OC
InChIInChI=1S/C15H32O2/c1-6-8-10-11-13-15(3,12-9-7-2)14(16-4)17-5/h14H,6-13H2,1-5H3
InChIKeyPWWYEOQYTJJMLT-UHFFFAOYSA-N
MW244.42 g/mol
LogP4.77
Rot. Bonds11

About 5-(dimethoxymethyl)-5-methylundecane

5-(dimethoxymethyl)-5-methylundecane (PubChem CID 139546819) has the molecular formula C15H32O2 and a molecular weight of 244.42 g/mol. Its IUPAC name is 5-(dimethoxymethyl)-5-methylundecane.

Molecular Properties

Compound Name5-(dimethoxymethyl)-5-methylundecane
PubChem CID139546819
Molecular FormulaC15H32O2
Molecular Weight244.42 g/mol
Exact Mass244.24
IUPAC Name5-(dimethoxymethyl)-5-methylundecane
SMILESCCCCCCC(C)(CCCC)C(OC)OC
InChIInChI=1S/C15H32O2/c1-6-8-10-11-13-15(3,12-9-7-2)14(16-4)17-5/h14H,6-13H2,1-5H3
InChIKeyPWWYEOQYTJJMLT-UHFFFAOYSA-N
XLogP4.77
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds11
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.42
LogP ≤ 54.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

1,1-dimethoxy-2,2-dimethylheptane
CID 173169063
1,1,2,2-tetramethoxyoctane
CID 15697911
1,1-dimethoxy-2-methylheptan-2-ol
CID 66038845
3-butyl-2,3-dimethylnonanenitrile
CID 167110400
6-methyl-6-propan-2-ylundecane
CID 87930599
3-ethyl-2,3-dimethylnonane
CID 57490996
3-ethyl-2,3-dimethyldecane
CID 57491701
5-butyl-5-methylpentadecane
CID 174700907
5,5,6,6-tetramethyltridecane
CID 173349107
2,2-dibutoxy-1-(2,2-dibutoxy-1-methoxytetradecoxy)-1-methoxytetradecane
CID 175166358
5-methyl-5-(trimethoxymethyl)tridecane
CID 150316109
7-butyltridecan-7-ylphosphane
CID 118892798

Frequently Asked Questions

What is the IUPAC name of 5-(dimethoxymethyl)-5-methylundecane?
The IUPAC name of 5-(dimethoxymethyl)-5-methylundecane (CID 139546819) is 5-(dimethoxymethyl)-5-methylundecane.
What is the SMILES notation for 5-(dimethoxymethyl)-5-methylundecane?
The canonical SMILES for 5-(dimethoxymethyl)-5-methylundecane is CCCCCCC(C)(CCCC)C(OC)OC.
What is the InChIKey of 5-(dimethoxymethyl)-5-methylundecane?
The InChIKey is PWWYEOQYTJJMLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H32O2/c1-6-8-10-11-13-15(3,12-9-7-2)14(16-4)17-5/h14H,6-13H2,1-5H3.
What are the key properties of 5-(dimethoxymethyl)-5-methylundecane?
5-(dimethoxymethyl)-5-methylundecane has a molecular weight of 244.42 g/mol, XLogP of 4.77, 11 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(dimethoxymethyl)-5-methylundecane is sourced from PubChem (CID 139546819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).