propyl N-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]carbamate

Base Information

• Chemical Name: propyl N-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]carbamate
• CAS No.: 102417-03-8
• Molecular Formula: C₁₆H₂₆N₂O₄
• Molecular Weight: 310.393
• DSSTox Substance ID: DTXSID30907492
• Nikkaji Number: J366.367A
• Mol file: 102417-03-8.mol

Synonyms:BL 343 Ac;BL 343 Ac hydrochloride;BL-343 Ac;propyl-4-((2-hydroxy-3-isopropylamino)propoxy)carbanilate

Chemical Property of propyl N-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]carbamate

Chemical Property:

• Vapor Pressure: 2.95E-08mmHg at 25°C
• Boiling Point: 432.7°Cat760mmHg
• Flash Point: 215.5°C
• PSA: 96.89000
• Density: 1.126g/cm³
• LogP: 3.85130
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 10
• Exact Mass: 310.18925731
• Heavy Atom Count: 22
• Complexity: 305

Purity/Quality:

BL 343 AC 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCOC(=O)NC1=CC=C(C=C1)OCC(CNC(C)C)O

Technology Process of propyl N-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]carbamate

There total 3 articles about propyl N-[4-[2-hydroxy-3-(propan-2-ylamino)propoxy]phenyl]carbamate 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:

(4-hydroxy-phenyl)-carbamic acid propyl ester (54840-13-0) → [4-(2-Hydroxy-3-isopropylamino-propoxy)-phenyl]-carbamic acid propyl ester (102417-03-8)

Guidance literature:

Multi-step reaction with 2 steps

1: NaOH / H₂O / 24 h / Ambient temperature

2: methanol / Heating

With sodium hydroxide; In methanol; water;

DOI:10.1016/0223-5234(91)90127-9

Reference yield:

4-amino-phenol (123-30-8) → [4-(2-Hydroxy-3-isopropylamino-propoxy)-phenyl]-carbamic acid propyl ester (102417-03-8)

Guidance literature:

Multi-step reaction with 3 steps

1: diethyl ether / 1 h

2: NaOH / H₂O / 24 h / Ambient temperature

3: methanol / Heating

With sodium hydroxide; In methanol; diethyl ether; water;

DOI:10.1016/0223-5234(91)90127-9

Reference yield:

(4-Oxiranylmethoxy-phenyl)-carbamic acid propyl ester (83263-97-2) + isopropylamine (75-31-0) → [4-(2-Hydroxy-3-isopropylamino-propoxy)-phenyl]-carbamic acid propyl ester (102417-03-8)

Guidance literature:

In methanol; Heating;

DOI:10.1016/0223-5234(91)90127-9

upstream raw materials:

(4-Oxiranylmethoxy-phenyl)-carbamic acid propyl ester

isopropylamine

(4-hydroxy-phenyl)-carbamic acid propyl ester

4-amino-phenol