[(1R)-1-[2-(2,5-difluorophenyl)oxiran-2-yl]ethoxy]phosphane

C10H11F2O2P — CID 59970524

IUPAC[(1R)-1-[2-(2,5-difluorophenyl)oxiran-2-yl]ethoxy]phosphane
SMILESC[C@@H](OP)C1(c2cc(F)ccc2F)CO1
InChIInChI=1S/C10H11F2O2P/c1-6(14-15)10(5-13-10)8-4-7(11)2-3-9(8)12/h2-4,6H,5,15H2,1H3/t6-,10?/m1/s1
InChIKeyBBPGYPOFRKRZAA-ZMMDDIOLSA-N
MW232.17 g/mol
LogP2.39
Rot. Bonds3

About [(1R)-1-[2-(2,5-difluorophenyl)oxiran-2-yl]ethoxy]phosphane

[(1R)-1-[2-(2,5-difluorophenyl)oxiran-2-yl]ethoxy]phosphane (PubChem CID 59970524) has the molecular formula C10H11F2O2P and a molecular weight of 232.17 g/mol. Its IUPAC name is [(1R)-1-[2-(2,5-difluorophenyl)oxiran-2-yl]ethoxy]phosphane.

Molecular Properties

Compound Name[(1R)-1-[2-(2,5-difluorophenyl)oxiran-2-yl]ethoxy]phosphane
PubChem CID59970524
Molecular FormulaC10H11F2O2P
Molecular Weight232.17 g/mol
Exact Mass232.05
IUPAC Name[(1R)-1-[2-(2,5-difluorophenyl)oxiran-2-yl]ethoxy]phosphane
SMILESC[C@@H](OP)C1(c2cc(F)ccc2F)CO1
InChIInChI=1S/C10H11F2O2P/c1-6(14-15)10(5-13-10)8-4-7(11)2-3-9(8)12/h2-4,6H,5,15H2,1H3/t6-,10?/m1/s1
InChIKeyBBPGYPOFRKRZAA-ZMMDDIOLSA-N
XLogP2.39
TPSA21.76 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.17
LogP ≤ 52.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-[(1R)-1-[(2R)-2-(2,5-difluorophenyl)oxiran-2-yl]ethoxy]oxane
CID 58224184
(1S)-1-[(2S)-2-(2,4-difluorophenyl)oxiran-2-yl]ethanol
CID 10899632
[(1S)-1-[(2R)-2-(2,4-difluorophenyl)oxiran-2-yl]ethyl] trifluoromethanesulfonate
CID 10758948
2-[(1S)-1-[(2S)-2-(2,4-difluorophenyl)oxiran-2-yl]ethoxy]oxane
CID 10085270
(2S)-2-[(2R)-2-(2,4-difluorophenyl)oxiran-2-yl]propan-1-ol
CID 139793678
1-[1-(2,5-difluorophenyl)cyclopropyl]ethanol
CID 83686225
1-(4-chlorophenyl)-5-[1-[2-(2,4-difluorophenyl)oxiran-2-yl]ethoxy]-1,2,4-triazole
CID 19373645
2-[3-(2,5-difluorophenyl)oxetan-3-yl]-3-methylbutanenitrile
CID 116875560
2-(2,5-difluorophenyl)-2-propyl-1,3-dioxolane
CID 83958425
(2S)-2-(2,4-difluorophenyl)-2-methyloxirane
CID 123185465
cis-(1R,2S)-2-(2,5-difluorophenyl)-2-methylcyclopropane-1-carboxylic acid
CID 94256560
[3-(2,5-difluorophenyl)oxetan-3-yl]methanamine
CID 83485213

Frequently Asked Questions

What is the IUPAC name of [(1R)-1-[2-(2,5-difluorophenyl)oxiran-2-yl]ethoxy]phosphane?
The IUPAC name of [(1R)-1-[2-(2,5-difluorophenyl)oxiran-2-yl]ethoxy]phosphane (CID 59970524) is [(1R)-1-[2-(2,5-difluorophenyl)oxiran-2-yl]ethoxy]phosphane.
What is the SMILES notation for [(1R)-1-[2-(2,5-difluorophenyl)oxiran-2-yl]ethoxy]phosphane?
The canonical SMILES for [(1R)-1-[2-(2,5-difluorophenyl)oxiran-2-yl]ethoxy]phosphane is C[C@@H](OP)C1(c2cc(F)ccc2F)CO1.
What is the InChIKey of [(1R)-1-[2-(2,5-difluorophenyl)oxiran-2-yl]ethoxy]phosphane?
The InChIKey is BBPGYPOFRKRZAA-ZMMDDIOLSA-N. The full InChI is InChI=1S/C10H11F2O2P/c1-6(14-15)10(5-13-10)8-4-7(11)2-3-9(8)12/h2-4,6H,5,15H2,1H3/t6-,10?/m1/s1.
What are the key properties of [(1R)-1-[2-(2,5-difluorophenyl)oxiran-2-yl]ethoxy]phosphane?
[(1R)-1-[2-(2,5-difluorophenyl)oxiran-2-yl]ethoxy]phosphane has a molecular weight of 232.17 g/mol, XLogP of 2.39, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(1R)-1-[2-(2,5-difluorophenyl)oxiran-2-yl]ethoxy]phosphane is sourced from PubChem (CID 59970524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).