(1R)-1-[2-(methoxymethoxy)-4-propylphenyl]propan-1-ol

C14H22O3 — CID 129384363

IUPAC(1R)-1-[2-(methoxymethoxy)-4-propylphenyl]propan-1-ol
SMILESCCCc1ccc([C@H](O)CC)c(OCOC)c1
InChIInChI=1S/C14H22O3/c1-4-6-11-7-8-12(13(15)5-2)14(9-11)17-10-16-3/h7-9,13,15H,4-6,10H2,1-3H3/t13-/m1/s1
InChIKeyFEDSXLXNALJUJJ-CYBMUJFWSA-N
MW238.33 g/mol
LogP3.07
Rot. Bonds7

About (1R)-1-[2-(methoxymethoxy)-4-propylphenyl]propan-1-ol

(1R)-1-[2-(methoxymethoxy)-4-propylphenyl]propan-1-ol (PubChem CID 129384363) has the molecular formula C14H22O3 and a molecular weight of 238.33 g/mol. Its IUPAC name is (1R)-1-[2-(methoxymethoxy)-4-propylphenyl]propan-1-ol.

Molecular Properties

Compound Name(1R)-1-[2-(methoxymethoxy)-4-propylphenyl]propan-1-ol
PubChem CID129384363
Molecular FormulaC14H22O3
Molecular Weight238.33 g/mol
Exact Mass238.16
IUPAC Name(1R)-1-[2-(methoxymethoxy)-4-propylphenyl]propan-1-ol
SMILESCCCc1ccc([C@H](O)CC)c(OCOC)c1
InChIInChI=1S/C14H22O3/c1-4-6-11-7-8-12(13(15)5-2)14(9-11)17-10-16-3/h7-9,13,15H,4-6,10H2,1-3H3/t13-/m1/s1
InChIKeyFEDSXLXNALJUJJ-CYBMUJFWSA-N
XLogP3.07
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.33
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (1R)-1-[2-(methoxymethoxy)-4-propylphenyl]propan-1-ol?
The IUPAC name of (1R)-1-[2-(methoxymethoxy)-4-propylphenyl]propan-1-ol (CID 129384363) is (1R)-1-[2-(methoxymethoxy)-4-propylphenyl]propan-1-ol.
What is the SMILES notation for (1R)-1-[2-(methoxymethoxy)-4-propylphenyl]propan-1-ol?
The canonical SMILES for (1R)-1-[2-(methoxymethoxy)-4-propylphenyl]propan-1-ol is CCCc1ccc([C@H](O)CC)c(OCOC)c1.
What is the InChIKey of (1R)-1-[2-(methoxymethoxy)-4-propylphenyl]propan-1-ol?
The InChIKey is FEDSXLXNALJUJJ-CYBMUJFWSA-N. The full InChI is InChI=1S/C14H22O3/c1-4-6-11-7-8-12(13(15)5-2)14(9-11)17-10-16-3/h7-9,13,15H,4-6,10H2,1-3H3/t13-/m1/s1.
What are the key properties of (1R)-1-[2-(methoxymethoxy)-4-propylphenyl]propan-1-ol?
(1R)-1-[2-(methoxymethoxy)-4-propylphenyl]propan-1-ol has a molecular weight of 238.33 g/mol, XLogP of 3.07, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1-[2-(methoxymethoxy)-4-propylphenyl]propan-1-ol is sourced from PubChem (CID 129384363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).