4-Methyl-5,6,7,8-tetrahydroquinazolin-2-amine

Base Information

• Chemical Name: 4-Methyl-5,6,7,8-tetrahydroquinazolin-2-amine
• CAS No.: 58544-43-7
• Molecular Formula: C9H13N3
• Molecular Weight: 163.22
• Hs Code.: 2933990090
• ChEMBL ID: CHEMBL1536385
• DSSTox Substance ID: DTXSID30406995
• Nikkaji Number: J3.484.934J
• Mol file: 58544-43-7.mol

Synonyms:4-methyl-5,6,7,8-tetrahydroquinazolin-2-amine;58544-43-7;MLS000567269;4-methyl-5,6,7,8-tetrahydro-2-quinazolinamine;SMR000153990;Opera_ID_19;CHEMBL1536385;SCHEMBL10663924;DTXSID30406995;HMS1748F05;HMS2164H23;HMS3324J18;MFCD06655499;AKOS005265066;LS-05968;CS-0232635;EN300-12787;2-Amino-4-methyl-5,6,7,8-tetrahydrochinazolin;Z85923113;N-tert-Butoxylcarbonyl-3-(benzo[b]thiophen-3-yl)-D-alanine

Chemical Property of 4-Methyl-5,6,7,8-tetrahydroquinazolin-2-amine

Chemical Property:

• Vapor Pressure: 1.11E-05mmHg at 25°C
• Boiling Point: 370.3°Cat760mmHg
• Flash Point: 205.5°C
• PSA: 51.80000
• Density: 1.155g/cm³
• LogP: 1.82720
• XLogP3: 1.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 163.110947427
• Heavy Atom Count: 12
• Complexity: 160

Purity/Quality:

98%min ^*data from raw suppliers

4-methyl-5,6,7,8-tetrahydroquinazolin-2-amine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C2CCCCC2=NC(=N1)N

Technology Process of 4-Methyl-5,6,7,8-tetrahydroquinazolin-2-amine

There total 3 articles about 4-Methyl-5,6,7,8-tetrahydroquinazolin-2-amine 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:

2-acetylcyclohexanone (874-23-7,125117-37-5) + guanidine nitrate (506-93-4) → 4-methyl-5,6,7,8-tetrahydro-quinazolin-2-ylamine (58544-43-7)

Guidance literature:

With sodium ethanolate;

Reference yield:

2-acetylcyclohexanone (874-23-7,125117-37-5) + sodium ethanolate (141-52-6) + guanidine nitrate (506-93-4) → 4-methyl-5,6,7,8-tetrahydro-quinazolin-2-ylamine (58544-43-7)

Guidance literature:

Reference yield:

→ 4-methyl-5,6,7,8-tetrahydro-quinazolin-2-ylamine (58544-43-7)

Guidance literature:

Hexahydrochinazolin 13, NaOEt;

DOI:10.1007/BF00913623

upstream raw materials:

2-acetylcyclohexanone

sodium ethanolate

guanidine nitrate