(2R)-1-methoxy-3-(trideuteriomethoxy)propan-2-ol

C5H12O3 — CID 138753644

IUPAC(2R)-1-methoxy-3-(trideuteriomethoxy)propan-2-ol
SMILES[2H]C([2H])([2H])OC[C@H](O)COC
InChIInChI=1S/C5H12O3/c1-7-3-5(6)4-8-2/h5-6H,3-4H2,1-2H3/i1D3/t5-/m0/s1
InChIKeyZESKRVSPQJVIMH-OLMANOAPSA-N
MW123.17 g/mol
LogP-0.36
Rot. Bonds5

About (2R)-1-methoxy-3-(trideuteriomethoxy)propan-2-ol

(2R)-1-methoxy-3-(trideuteriomethoxy)propan-2-ol (PubChem CID 138753644) has the molecular formula C5H12O3 and a molecular weight of 123.17 g/mol. Its IUPAC name is (2R)-1-methoxy-3-(trideuteriomethoxy)propan-2-ol.

Molecular Properties

Compound Name(2R)-1-methoxy-3-(trideuteriomethoxy)propan-2-ol
PubChem CID138753644
Molecular FormulaC5H12O3
Molecular Weight123.17 g/mol
Exact Mass123.10
IUPAC Name(2R)-1-methoxy-3-(trideuteriomethoxy)propan-2-ol
SMILES[2H]C([2H])([2H])OC[C@H](O)COC
InChIInChI=1S/C5H12O3/c1-7-3-5(6)4-8-2/h5-6H,3-4H2,1-2H3/i1D3/t5-/m0/s1
InChIKeyZESKRVSPQJVIMH-OLMANOAPSA-N
XLogP-0.36
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500123.17
LogP ≤ 5-0.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (2R)-1-methoxy-3-(trideuteriomethoxy)propan-2-ol?
The IUPAC name of (2R)-1-methoxy-3-(trideuteriomethoxy)propan-2-ol (CID 138753644) is (2R)-1-methoxy-3-(trideuteriomethoxy)propan-2-ol.
What is the SMILES notation for (2R)-1-methoxy-3-(trideuteriomethoxy)propan-2-ol?
The canonical SMILES for (2R)-1-methoxy-3-(trideuteriomethoxy)propan-2-ol is [2H]C([2H])([2H])OC[C@H](O)COC.
What is the InChIKey of (2R)-1-methoxy-3-(trideuteriomethoxy)propan-2-ol?
The InChIKey is ZESKRVSPQJVIMH-OLMANOAPSA-N. The full InChI is InChI=1S/C5H12O3/c1-7-3-5(6)4-8-2/h5-6H,3-4H2,1-2H3/i1D3/t5-/m0/s1.
What are the key properties of (2R)-1-methoxy-3-(trideuteriomethoxy)propan-2-ol?
(2R)-1-methoxy-3-(trideuteriomethoxy)propan-2-ol has a molecular weight of 123.17 g/mol, XLogP of -0.36, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-1-methoxy-3-(trideuteriomethoxy)propan-2-ol is sourced from PubChem (CID 138753644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).