[(2S,5R)-5-ethyl-2,4-dimethyloxolan-3-yl]oxy-methyl-[[(2S,5S)-3,4,5-trimethyloxolan-2-yl]methoxy]phosphane

C17H33O4P — CID 59637572

IUPAC[(2S,5R)-5-ethyl-2,4-dimethyloxolan-3-yl]oxy-methyl-[[(2S,5S)-3,4,5-trimethyloxolan-2-yl]methoxy]phosphane
SMILESCC[C@H]1O[C@@H](C)C(OP(C)OC[C@H]2O[C@@H](C)C(C)C2C)C1C
InChIInChI=1S/C17H33O4P/c1-8-15-12(4)17(14(6)20-15)21-22(7)18-9-16-11(3)10(2)13(5)19-16/h10-17H,8-9H2,1-7H3/t10?,11?,12?,13-,14-,15+,16+,17?,22?/m0/s1
InChIKeyBSGJAQMNHKSAHQ-NWLUKMKVSA-N
MW332.42 g/mol
LogP4.22
Rot. Bonds6

About [(2S,5R)-5-ethyl-2,4-dimethyloxolan-3-yl]oxy-methyl-[[(2S,5S)-3,4,5-trimethyloxolan-2-yl]methoxy]phosphane

[(2S,5R)-5-ethyl-2,4-dimethyloxolan-3-yl]oxy-methyl-[[(2S,5S)-3,4,5-trimethyloxolan-2-yl]methoxy]phosphane (PubChem CID 59637572) has the molecular formula C17H33O4P and a molecular weight of 332.42 g/mol. Its IUPAC name is [(2S,5R)-5-ethyl-2,4-dimethyloxolan-3-yl]oxy-methyl-[[(2S,5S)-3,4,5-trimethyloxolan-2-yl]methoxy]phosphane.

Molecular Properties

Compound Name[(2S,5R)-5-ethyl-2,4-dimethyloxolan-3-yl]oxy-methyl-[[(2S,5S)-3,4,5-trimethyloxolan-2-yl]methoxy]phosphane
PubChem CID59637572
Molecular FormulaC17H33O4P
Molecular Weight332.42 g/mol
Exact Mass332.21
IUPAC Name[(2S,5R)-5-ethyl-2,4-dimethyloxolan-3-yl]oxy-methyl-[[(2S,5S)-3,4,5-trimethyloxolan-2-yl]methoxy]phosphane
SMILESCC[C@H]1O[C@@H](C)C(OP(C)OC[C@H]2O[C@@H](C)C(C)C2C)C1C
InChIInChI=1S/C17H33O4P/c1-8-15-12(4)17(14(6)20-15)21-22(7)18-9-16-11(3)10(2)13(5)19-16/h10-17H,8-9H2,1-7H3/t10?,11?,12?,13-,14-,15+,16+,17?,22?/m0/s1
InChIKeyBSGJAQMNHKSAHQ-NWLUKMKVSA-N
XLogP4.22
TPSA36.92 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.42
LogP ≤ 54.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [(2S,5R)-5-ethyl-2,4-dimethyloxolan-3-yl]oxy-methyl-[[(2S,5S)-3,4,5-trimethyloxolan-2-yl]methoxy]phosphane?
The IUPAC name of [(2S,5R)-5-ethyl-2,4-dimethyloxolan-3-yl]oxy-methyl-[[(2S,5S)-3,4,5-trimethyloxolan-2-yl]methoxy]phosphane (CID 59637572) is [(2S,5R)-5-ethyl-2,4-dimethyloxolan-3-yl]oxy-methyl-[[(2S,5S)-3,4,5-trimethyloxolan-2-yl]methoxy]phosphane.
What is the SMILES notation for [(2S,5R)-5-ethyl-2,4-dimethyloxolan-3-yl]oxy-methyl-[[(2S,5S)-3,4,5-trimethyloxolan-2-yl]methoxy]phosphane?
The canonical SMILES for [(2S,5R)-5-ethyl-2,4-dimethyloxolan-3-yl]oxy-methyl-[[(2S,5S)-3,4,5-trimethyloxolan-2-yl]methoxy]phosphane is CC[C@H]1O[C@@H](C)C(OP(C)OC[C@H]2O[C@@H](C)C(C)C2C)C1C.
What is the InChIKey of [(2S,5R)-5-ethyl-2,4-dimethyloxolan-3-yl]oxy-methyl-[[(2S,5S)-3,4,5-trimethyloxolan-2-yl]methoxy]phosphane?
The InChIKey is BSGJAQMNHKSAHQ-NWLUKMKVSA-N. The full InChI is InChI=1S/C17H33O4P/c1-8-15-12(4)17(14(6)20-15)21-22(7)18-9-16-11(3)10(2)13(5)19-16/h10-17H,8-9H2,1-7H3/t10?,11?,12?,13-,14-,15+,16+,17?,22?/m0/s1.
What are the key properties of [(2S,5R)-5-ethyl-2,4-dimethyloxolan-3-yl]oxy-methyl-[[(2S,5S)-3,4,5-trimethyloxolan-2-yl]methoxy]phosphane?
[(2S,5R)-5-ethyl-2,4-dimethyloxolan-3-yl]oxy-methyl-[[(2S,5S)-3,4,5-trimethyloxolan-2-yl]methoxy]phosphane has a molecular weight of 332.42 g/mol, XLogP of 4.22, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S,5R)-5-ethyl-2,4-dimethyloxolan-3-yl]oxy-methyl-[[(2S,5S)-3,4,5-trimethyloxolan-2-yl]methoxy]phosphane is sourced from PubChem (CID 59637572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).