(2R,3S)-3-methyl-2-phenylselanyloxolane

C11H14OSe — CID 15890900

IUPAC(2R,3S)-3-methyl-2-phenylselanyloxolane
SMILESC[C@H]1CCO[C@@H]1[Se]c1ccccc1
InChIInChI=1S/C11H14OSe/c1-9-7-8-12-11(9)13-10-5-3-2-4-6-10/h2-6,9,11H,7-8H2,1H3/t9-,11+/m0/s1
InChIKeyLFPZJESLULMZLZ-GXSJLCMTSA-N
MW241.19 g/mol
LogP1.40
Rot. Bonds2

About (2R,3S)-3-methyl-2-phenylselanyloxolane

(2R,3S)-3-methyl-2-phenylselanyloxolane (PubChem CID 15890900) has the molecular formula C11H14OSe and a molecular weight of 241.19 g/mol. Its IUPAC name is (2R,3S)-3-methyl-2-phenylselanyloxolane.

Molecular Properties

Compound Name(2R,3S)-3-methyl-2-phenylselanyloxolane
PubChem CID15890900
Molecular FormulaC11H14OSe
Molecular Weight241.19 g/mol
Exact Mass242.02
IUPAC Name(2R,3S)-3-methyl-2-phenylselanyloxolane
SMILESC[C@H]1CCO[C@@H]1[Se]c1ccccc1
InChIInChI=1S/C11H14OSe/c1-9-7-8-12-11(9)13-10-5-3-2-4-6-10/h2-6,9,11H,7-8H2,1H3/t9-,11+/m0/s1
InChIKeyLFPZJESLULMZLZ-GXSJLCMTSA-N
XLogP1.40
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.19
LogP ≤ 51.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-phenylselanyloxane
CID 11118188
3-bromo-4-methyl-2-phenyloxane
CID 154134533
7-phenylselanyl-2,3,3a,4,5,6,7,7a-octahydro-1-benzofuran
CID 12654992
(2R,3S)-2-phenyl-3-phenylselanyloxane
CID 101160318
(3aR,4S,7R,7aS)-2,2-dimethyl-4-phenylselanyl-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran-7-ol
CID 10925515
2,6-bis(phenylselanyl)-9-oxabicyclo[3.3.1]nonane
CID 12529951
(4,5-diacetyloxy-2-methyl-6-phenylselanyloxan-3-yl) acetate
CID 135078121
(3-methyloxolan-2-yl) benzenesulfonate
CID 141025105
(2S,3R)-2-(2-methoxyphenyl)-3-phenylselanyloxane
CID 134882559
N,N-dimethylmethanamine;2-phenyloxolane
CID 71271242
(2R)-2-[(1S)-1-phenylselanylethyl]oxolane
CID 102417969
(2S)-2-(1-phenylselanylethyl)oxolane
CID 137284926

Frequently Asked Questions

What is the IUPAC name of (2R,3S)-3-methyl-2-phenylselanyloxolane?
The IUPAC name of (2R,3S)-3-methyl-2-phenylselanyloxolane (CID 15890900) is (2R,3S)-3-methyl-2-phenylselanyloxolane.
What is the SMILES notation for (2R,3S)-3-methyl-2-phenylselanyloxolane?
The canonical SMILES for (2R,3S)-3-methyl-2-phenylselanyloxolane is C[C@H]1CCO[C@@H]1[Se]c1ccccc1.
What is the InChIKey of (2R,3S)-3-methyl-2-phenylselanyloxolane?
The InChIKey is LFPZJESLULMZLZ-GXSJLCMTSA-N. The full InChI is InChI=1S/C11H14OSe/c1-9-7-8-12-11(9)13-10-5-3-2-4-6-10/h2-6,9,11H,7-8H2,1H3/t9-,11+/m0/s1.
What are the key properties of (2R,3S)-3-methyl-2-phenylselanyloxolane?
(2R,3S)-3-methyl-2-phenylselanyloxolane has a molecular weight of 241.19 g/mol, XLogP of 1.40, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3S)-3-methyl-2-phenylselanyloxolane is sourced from PubChem (CID 15890900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).