(8R)-8-(methoxymethyl)-8-methylhexadecane

C19H40O — CID 168510199

IUPAC(8R)-8-(methoxymethyl)-8-methylhexadecane
SMILESCCCCCCCC[C@@](C)(CCCCCCC)COC
InChIInChI=1S/C19H40O/c1-5-7-9-11-13-15-17-19(3,18-20-4)16-14-12-10-8-6-2/h5-18H2,1-4H3/t19-/m1/s1
InChIKeyHRXUKWIVCXGRTE-LJQANCHMSA-N
MW284.53 g/mol
LogP6.75
Rot. Bonds15

About (8R)-8-(methoxymethyl)-8-methylhexadecane

(8R)-8-(methoxymethyl)-8-methylhexadecane (PubChem CID 168510199) has the molecular formula C19H40O and a molecular weight of 284.53 g/mol. Its IUPAC name is (8R)-8-(methoxymethyl)-8-methylhexadecane.

Molecular Properties

Compound Name(8R)-8-(methoxymethyl)-8-methylhexadecane
PubChem CID168510199
Molecular FormulaC19H40O
Molecular Weight284.53 g/mol
Exact Mass284.31
IUPAC Name(8R)-8-(methoxymethyl)-8-methylhexadecane
SMILESCCCCCCCC[C@@](C)(CCCCCCC)COC
InChIInChI=1S/C19H40O/c1-5-7-9-11-13-15-17-19(3,18-20-4)16-14-12-10-8-6-2/h5-18H2,1-4H3/t19-/m1/s1
InChIKeyHRXUKWIVCXGRTE-LJQANCHMSA-N
XLogP6.75
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 ≤ 56.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze (8R)-8-(methoxymethyl)-8-methylhexadecane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (8R)-8-(methoxymethyl)-8-methylhexadecane?
The IUPAC name of (8R)-8-(methoxymethyl)-8-methylhexadecane (CID 168510199) is (8R)-8-(methoxymethyl)-8-methylhexadecane.
What is the SMILES notation for (8R)-8-(methoxymethyl)-8-methylhexadecane?
The canonical SMILES for (8R)-8-(methoxymethyl)-8-methylhexadecane is CCCCCCCC[C@@](C)(CCCCCCC)COC.
What is the InChIKey of (8R)-8-(methoxymethyl)-8-methylhexadecane?
The InChIKey is HRXUKWIVCXGRTE-LJQANCHMSA-N. The full InChI is InChI=1S/C19H40O/c1-5-7-9-11-13-15-17-19(3,18-20-4)16-14-12-10-8-6-2/h5-18H2,1-4H3/t19-/m1/s1.
What are the key properties of (8R)-8-(methoxymethyl)-8-methylhexadecane?
(8R)-8-(methoxymethyl)-8-methylhexadecane has a molecular weight of 284.53 g/mol, XLogP of 6.75, 15 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (8R)-8-(methoxymethyl)-8-methylhexadecane is sourced from PubChem (CID 168510199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).