BARBITURIC ACID, 1-(p-CHLOROPHENYL)-2-THIO-

Base Information

• Chemical Name: BARBITURIC ACID, 1-(p-CHLOROPHENYL)-2-THIO-
• CAS No.: 28921-30-4
• Molecular Formula: C₁₀H₇ClN₂O₂S
• Molecular Weight: 254.697
• DSSTox Substance ID: DTXSID80183123
• Nikkaji Number: J62.434I
• Mol file: 28921-30-4.mol

Synonyms:28921-30-4;1-(4-chlorophenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione;BARBITURIC ACID, 1-(p-CHLOROPHENYL)-2-THIO-;BRN 0885435;1-(p-Chlorophenyl)-2-thiobarbituric acid;1-(4-Chlorophenyl)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione;1-(p-Chlorophenyl)-2-thioxo-2,3-dihydropyrimidine-4,6(1H,5H)-dione;5-24-09-00110 (Beilstein Handbook Reference);Oprea1_491765;DTXSID80183123;C10-H7-Cl-N2-O2-S;1-(4-chlorophenyl)-2-thioxodihydropyrimidine-4,6(1H,5H)-dione;STL382202;AKOS000323917;LS-24033;CS-0116609;EU-0045155;SR-01000495285;SR-01000495285-1

Chemical Property of BARBITURIC ACID, 1-(p-CHLOROPHENYL)-2-THIO-

Chemical Property:

• PSA: 84.99000
• Density: 1.57g/cm³
• LogP: 1.81870
• XLogP3: 1.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 253.9916763
• Heavy Atom Count: 16
• Complexity: 340

Purity/Quality:

99% ^*data from raw suppliers

1-(4-CHLOROPHENYL)-2-THIOXODIHYDRO-4,6(1H,5H)-PYRIMIDINEDIONE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C(=O)NC(=S)N(C1=O)C2=CC=C(C=C2)Cl

Technology Process of BARBITURIC ACID, 1-(p-CHLOROPHENYL)-2-THIO-

There total 2 articles about BARBITURIC ACID, 1-(p-CHLOROPHENYL)-2-THIO- 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:

diethyl malonate (105-53-3) + N-(4-chlorophenyl)thiourea (3696-23-9) → 1-(p-Chlorophenyl)-2-thiobarbituric acid (28921-30-4)

Guidance literature:

DOI:10.1023/A:1014821016904

Reference yield:

→ 1-(p-Chlorophenyl)-2-thiobarbituric acid (28921-30-4)

Guidance literature:

N-p-Chlorphenylthioharnstoff, Kohlenstoffsuboxid;

Reference yield: 80.0%

C8H9ClN2O (64119-09-1) + 1-(p-Chlorophenyl)-2-thiobarbituric acid (28921-30-4) → 2-[1-(4-Chloro-phenyl)-4,6-dioxo-1,4,5,6-tetrahydro-pyrimidin-2-yl]-1-(4-methoxy-phenyl)-isothiourea; hydrochloride (93084-97-0)

Guidance literature:

In acetone; for 1h;

DOI:10.1021/je00039a038

upstream raw materials:

diethyl malonate

N-(4-chlorophenyl)thiourea

Downstream raw materials:

2-[1-(4-Chloro-phenyl)-4,6-dioxo-1,4,5,6-tetrahydro-pyrimidin-2-yl]-1-(4-methoxy-phenyl)-isothiourea; hydrochloride

2-[1-(4-Chloro-phenyl)-4,6-dioxo-1,4,5,6-tetrahydro-pyrimidin-2-yl]-1-phenyl-isothiourea; hydrochloride

1-(4-Chloro-phenyl)-2-[1-(4-chloro-phenyl)-4,6-dioxo-1,4,5,6-tetrahydro-pyrimidin-2-yl]-isothiourea; hydrochloride

1-(3-Chloro-phenyl)-2-[1-(4-chloro-phenyl)-4,6-dioxo-1,4,5,6-tetrahydro-pyrimidin-2-yl]-isothiourea; hydrochloride

Post a RFQ

Cas No.:

Product Name:

Quantity:

Please select Metric Ton KG G Pound L ML

Email:

Company name:

Valid Period:

Detailed Requirements:

• Sample
• MOQ
• GMP
• FDA
• Price
  FOB CIF CFR EXW
• Urgent purchase

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

Remove

Submit

1

What can I do for you?
Get Best Price

Get Best Price for 28921-30-4 1-(p-Chlorophenyl)-2-thioxo-2,3-dihydropyrimidine-4,6(1H,5H)-dione

Send

Send

Metric Ton KG G Pound L ML

Send

Send