ol

• ChemBase ID: 136941
• Molecular Formular: C11H22FNO4P
• Molecular Mass: 282.2688442
• Monoisotopic Mass: 282.12704804
• SMILES: CCOP(=O)(OC1CC(N(C(C1)(C)C)[O])(C)C)F
• Canonical SMILES: CCOP(=O)(OC1CC(C)(C)N(C(C1)(C)C)[O])F
• InChI: InChI=1S/C11H22FNO4P/c1-6-16-18(12,15)17-9-7-10(2,3)13(14)11(4,5)8-9/h9H,6-8H2,1-5H3
• InChIKey: PEKVLLLJUKXMKZ-UHFFFAOYSA-N

NAMES AND DATABASE IDS

Names

• IUPAC name: ol
• IUPAC Traditional name: tyrosine(.)
• Synonyms: 4-[(Ethoxyflorophosphinyl)oxy]-2,2,6,6,-tetramethyl-1-piperidine-1-oxyl4-Hydroxy-2,2,6,6-tetramethylpiperidino-1-oxyl monoethyl phosphorofluoridate ester; 4-Ethoxyfluorophosphinyloxy TEMPO; 4-(Ethoxyfluorophosphinyloxy)-2,2,6,6-tetramethyl-1-piperidinyloxy, free radical; 4-(Ethoxyfluorophosphinyloxy)-TEMPO; 4-(乙氧基氟膦基氧)-2,2,6,6-四甲基-1-哌啶氮氧自由基; 4-(乙氧基氟膦基氧)-TEMPO

Database IDs

• CAS Number: 37566-53-3
• MDL Number: MFCD00010172
• PubChem SID: 162231208
• PubChem CID: 71310009

CALCULATED PROPERTIES

• Log P: 1.3116318
• Molar Refractivity: 66.2151 cm^3
• Polarizability: 26.530134 Å^3
• Polar Surface Area: 38.77 Å^2
• Rotatable Bonds: 4
• Lipinski's Rule of Five: true
• H Acceptors: 3
• H Donor: 0
• LogD (pH = 5.5): 1.3116318
• LogD (pH = 7.4): 1.3116318

PROPERTIES

Physical Property

• Solubility: Chloroform
• Apperance: Red Oil
• Flash Point: 141.8 °F; 61 °C

Safety Information

• Storage Condition: -20°C Freezer
• European Hazard Symbols: Toxic (T)
• German water hazard class: 3
• Risk Statements: 23/24/25-36/37/38
• Safety Statements: 23-26-36/37/39-45
• GHS Pictograms: GHS06
• GHS Signal Word: Danger
• GHS Hazard statements: H301-H311-H315-H319-H331-H335
• GHS Precautionary statements: P261-P280-P301 + P310-P305 + P351 + P338-P311
• Personal Protective Equipment: Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter

Product Information

• Empirical Formula (Hill Notation): C11H23FNO4P

DETAILS

Sigma Aldrich - 253553

Features and Benefits
Spin label.

Toronto Research Chemicals - E892025

A spin label.