1-(2-Morpholinoethyl)-2-thiourea

Base Information

• Chemical Name: 1-(2-Morpholinoethyl)-2-thiourea
• CAS No.: 122641-10-5
• Molecular Formula: C7H15N3OS
• Molecular Weight: 189.282
• Hs Code.: 2934999090
• European Community (EC) Number: 673-723-8
• NSC Number: 372190
• DSSTox Substance ID: DTXSID70375035
• Mol file: 122641-10-5.mol

Synonyms:1-(2-Morpholinoethyl)-2-thiourea;122641-10-5;1-(2-Morpholinoethyl)thiourea;2-morpholin-4-ylethylthiourea;NSC372190;2-(4-morpholinyl)ethylthiourea;SCHEMBL1606290;DTXSID70375035;MIVHEVIWHMEELG-UHFFFAOYSA-N;(2-morpholin-4-yl-ethyl)-thiourea;[2-(morpholin-4-yl)ethyl]thiourea;1-(2-morpholin-4-ylethyl)thiourea;N-(2-morpholin-4-ylethyl)thiourea;MFCD00135123;N-[2-(4-morpholinyl)ethyl]thiourea;AKOS009281141;NSC-372190;AS-82174;CS-0456319;FT-0642985;A804935;J-004838

Chemical Property of 1-(2-Morpholinoethyl)-2-thiourea

Chemical Property:

• Vapor Pressure: 0.00029mmHg at 25°C
• Melting Point: 105-108oC
• Boiling Point: 321.9oC at 760 mmHg
• PKA: 14.62±0.70(Predicted)
• Flash Point: 148.5oC
• PSA: 82.61000
• Density: 1.182g/cm3
• LogP: 0.18090
• XLogP3: -0.8
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 189.09358328
• Heavy Atom Count: 12
• Complexity: 148

Purity/Quality:

98%,99%, ^*data from raw suppliers

1-(2-Morpholinoethyl)-2-thiourea ^*data from reagent suppliers

Safty Information:

• Statements: 36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1COCCN1CCNC(=S)N

Technology Process of 1-(2-Morpholinoethyl)-2-thiourea

There total 3 articles about 1-(2-Morpholinoethyl)-2-thiourea 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: 99.0%

2-morpholinoethyl isothiocyanate (63224-35-1) → 1-(2-morpholinoethyl)thiourea (122641-10-5)

Guidance literature:

With ammonia; In 1,2-dimethoxyethane;

DOI:10.1055/s-0031-1290963

Reference yield: 47.0%

→ 1-(2-morpholinoethyl)thiourea (122641-10-5)

Guidance literature:

With hydrazine hydrate; at 20 ℃; for 3h;

Reference yield:

4-(2-aminoethyl)morpholine hydrochloride (90746-30-8) → 1-(2-morpholinoethyl)thiourea (122641-10-5)

Guidance literature:

Multi-step reaction with 2 steps

1: aq. NaHCO₃ / CHCl₃ / 0.5 h

2: NH₃ / methanol / 12 h

With ammonia; sodium hydrogencarbonate; In methanol; chloroform;

DOI:10.1016/S0960-894X(01)00102-0

upstream raw materials:

2-morpholinoethyl isothiocyanate

4-(2-aminoethyl)morpholine hydrochloride

Downstream raw materials:

C₂₈H₃₁N₃O₅S

2,6-difluoro-N-(3-(2-((2-(4-morpholinyl)ethyl)amino)-5-(2-((2-(trifluoroacetyl)-1,2,3,4-tetrahydro-7-isoquinolinyl)amino)-4-pyrimidinyl)-1,3-thiazol-4-yl)phenyl)benzamide

2,5-difluoro-N-(3-(5-(2-((3-fluoro-4-(methyloxy)phenyl)amino)-4-pyrimidinyl)-2-((2-(4-morpholinyl)ethyl)amino)-1,3-thiazol-4-yl)phenyl)benzamide

Refernces

• 1、 Browne, Duncanl.,O'Brien, Matthew,Koos, Peter,Cranwell, Philippa B.,Polyzos, Anastasios,Ley, Steven V.. "Continuous-flow processing of gaseous ammonia using a Teflon AF-2400 tube-in-tube reactor: Synthesis of thioureas and in-line titrations". scheme or table. p. 1402 - 1406. Retrieved 2012/07/27.