(3-Ethoxy-3-oxopropyl)triphenylphosphonium bromide

Base Information

• Chemical Name: (3-Ethoxy-3-oxopropyl)triphenylphosphonium bromide
• CAS No.: 42843-94-7
• Molecular Formula: Br*C₂₃H₂₄O₂P
• Molecular Weight: 443.32
• Hs Code.: 2931900090
• European Community (EC) Number: 640-200-0
• NSC Number: 131462
• UNII: Q1U7R24XWI
• DSSTox Substance ID: DTXSID00962735
• Mol file: 42843-94-7.mol

Synonyms:42843-94-7;(3-Ethoxy-3-oxopropyl)triphenylphosphonium bromide;2-(Ethoxycarbonyl)ethyltriphenylphosphonium bromide;2-(Ethoxycarbonyl)ethyl triphenylphosphonium bromide;(3-ethoxy-3-oxopropyl)-triphenylphosphanium;bromide;MFCD03701355;(3-Ethoxy-3-oxo-propyl)-triphenyl-phosphonium bromide;NSC-131462;NSC131462;(3-Ethoxy-3-oxopropyl)(triphenyl)phosphonium bromide;SCHEMBL1409249;DTXSID00962735;ANKBQEBRESYXDT-UHFFFAOYSA-M;AMY40752;ZB1735;AKOS005067806;CS-W005866;SY046990;FT-0694191;(3-Ethoxy-3-oxopropyl)triphenylphosphoniumbromide;A850234;CARBOETHOXYETHYLTRIPHENYLPHOSPHONIUM BROMIDE;2-(Ethoxycarbonyl)ethyltriphenyl-phosphonium bromide;(3-Ethoxy-3-oxopropyl)(triphenyl)phosphanium bromide;ETHYL 3-(TRIPHENYLPHOSPHORANYL)PROPANOYL BROMIDE;Phosphonium,(3-ethoxy-3-oxopropyl)triphenyl-,bromide(1:1);PHOSPHONIUM, (3-ETHOXY-3-OXOPROPYL)TRIPHENYL-, BROMIDE;(2-CARBOXYETHYL)TRIPHENYLPHOSPHONIUM BROMIDE, ETHYL ESTER;PHOSPHONIUM, (3-ETHOXY-3-OXOPROPYL)TRIPHENYL-, BROMIDE (1:1)

Chemical Property of (3-Ethoxy-3-oxopropyl)triphenylphosphonium bromide

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 39.89000
• Density: g/cm³
• LogP: 0.93770
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 8
• Exact Mass: 442.06973
• Heavy Atom Count: 27
• Complexity: 372

Purity/Quality:

97% ^*data from raw suppliers

2-(Ethoxycarbonyl)ethyltriphenyl-phosphonium bromide 95+% ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCOC(=O)CC[P+](C1=CC=CC=C1)(C2=CC=CC=C2)C3=CC=CC=C3.[Br-]

Technology Process of (3-Ethoxy-3-oxopropyl)triphenylphosphonium bromide

There total 1 articles about (3-Ethoxy-3-oxopropyl)triphenylphosphonium bromide which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

→ ethoxycarbonylethyltriphenylphosphonium bromide (42843-94-7)

Guidance literature:

Triphenylphosphin, β-Brom-propionsaeureaethylester;

Reference yield:

6-N-benzoyl-2',3'-O-isopropylideneadenosine-5'-aldehyde (43077-06-1) + ethoxycarbonylethyltriphenylphosphonium bromide (42843-94-7) → C25H27N5O6

Guidance literature:

ethoxycarbonylethyltriphenylphosphonium bromide; With n-butyllithium; In tetrahydrofuran; at 0 ℃; for 0.166667h; Inert atmosphere;

6-N-benzoyl-2',3'-O-isopropylideneadenosine-5'-aldehyde; In tetrahydrofuran; at -78 - 0 ℃; for 4.5h; Inert atmosphere;

DOI:10.1021/ml4002503

Reference yield:

3,4 difluorobenzaldehyde (34036-07-2) + ethoxycarbonylethyltriphenylphosphonium bromide (42843-94-7) → C12H12F2O2 (915944-38-6)

Guidance literature:

With potassium tert-butylate; In tetrahydrofuran; at 5 - 20 ℃; for 21h;

Downstream raw materials:

C₁₂H₁₂F₂O₂