(2R)-1-(methoxymethoxy)hexadecan-2-ol

C18H38O3 — CID 10518499

IUPAC(2R)-1-(methoxymethoxy)hexadecan-2-ol
SMILESCCCCCCCCCCCCCC[C@@H](O)COCOC
InChIInChI=1S/C18H38O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-18(19)16-21-17-20-2/h18-19H,3-17H2,1-2H3/t18-/m1/s1
InChIKeyGECQDAFHAXBBCM-GOSISDBHSA-N
MW302.50 g/mol
LogP5.06
Rot. Bonds17

About (2R)-1-(methoxymethoxy)hexadecan-2-ol

(2R)-1-(methoxymethoxy)hexadecan-2-ol (PubChem CID 10518499) has the molecular formula C18H38O3 and a molecular weight of 302.50 g/mol. Its IUPAC name is (2R)-1-(methoxymethoxy)hexadecan-2-ol.

Molecular Properties

Compound Name(2R)-1-(methoxymethoxy)hexadecan-2-ol
PubChem CID10518499
Molecular FormulaC18H38O3
Molecular Weight302.50 g/mol
Exact Mass302.28
IUPAC Name(2R)-1-(methoxymethoxy)hexadecan-2-ol
SMILESCCCCCCCCCCCCCC[C@@H](O)COCOC
InChIInChI=1S/C18H38O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-18(19)16-21-17-20-2/h18-19H,3-17H2,1-2H3/t18-/m1/s1
InChIKeyGECQDAFHAXBBCM-GOSISDBHSA-N
XLogP5.06
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds17
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500302.50
LogP ≤ 55.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze (2R)-1-(methoxymethoxy)hexadecan-2-ol with MolForge

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

Launch Full Analysis

Related Compounds

1-[2-(2-hydroxydodecoxy)ethoxy]dodecan-2-ol
CID 11796902
1-[2-(2-methoxyethoxy)ethoxy]octan-2-ol
CID 150741605
1-octoxydecan-2-ol
CID 57119039
1-octadecoxyicosan-2-ol
CID 88758338
(2S)-3-[(2R)-2-hydroxynonadecoxy]propane-1,2-diol
CID 137323866
(2S)-3-[(2R)-2-hydroxytetradecoxy]propane-1,2-diol
CID 137323862
3-(2,3-dihydroxypropoxy)propane-1,2-diol;hexadecane;icosan-9-ol
CID 174724990
1-[(2-methylpropan-2-yl)oxy]nonan-2-ol
CID 105084981
1-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-hydroxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]tetradecan-2-ol
CID 139267706
tetratetracontan-22-ol
CID 91434437
nonacosane-7,20-diol
CID 174949468
(7R)-hexatriacontan-7-ol
CID 88529159

Frequently Asked Questions

What is the IUPAC name of (2R)-1-(methoxymethoxy)hexadecan-2-ol?
The IUPAC name of (2R)-1-(methoxymethoxy)hexadecan-2-ol (CID 10518499) is (2R)-1-(methoxymethoxy)hexadecan-2-ol.
What is the SMILES notation for (2R)-1-(methoxymethoxy)hexadecan-2-ol?
The canonical SMILES for (2R)-1-(methoxymethoxy)hexadecan-2-ol is CCCCCCCCCCCCCC[C@@H](O)COCOC.
What is the InChIKey of (2R)-1-(methoxymethoxy)hexadecan-2-ol?
The InChIKey is GECQDAFHAXBBCM-GOSISDBHSA-N. The full InChI is InChI=1S/C18H38O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-18(19)16-21-17-20-2/h18-19H,3-17H2,1-2H3/t18-/m1/s1.
What are the key properties of (2R)-1-(methoxymethoxy)hexadecan-2-ol?
(2R)-1-(methoxymethoxy)hexadecan-2-ol has a molecular weight of 302.50 g/mol, XLogP of 5.06, 17 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-(methoxymethoxy)hexadecan-2-ol is sourced from PubChem (CID 10518499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).