2-Pyrimidinemethanamine

Base Information

• Chemical Name: 2-Pyrimidinemethanamine
• CAS No.: 75985-45-4
• Molecular Formula: C5H7 N3
• Molecular Weight: 109.131
• Hs Code.: 2933599090
• European Community (EC) Number: 804-700-4
• DSSTox Substance ID: DTXSID20405311
• Nikkaji Number: J2.782.869H
• Wikidata: Q72439562
• Mol file: 75985-45-4.mol

Synonyms:2-PYRIMIDINEMETHANAMINE;75985-45-4;Pyrimidin-2-ylmethanamine;2-Aminomethylpyrimidine;2-(Aminomethyl)pyrimidine;PYRIMIDIN-2-YL-METHYLAMINE;MFCD06212857;(pyrimidin-2-yl)methanamine;60348-81-4;2-aminomethyl-pyrimidine;pyrimidin-2-ylmethylamine;pyrimidine 2-ylmethylamine;SCHEMBL244917;DTXSID20405311;ROSKZJGILXBSFM-UHFFFAOYSA-N;(2-PYRIMIDINYLMETHYL)AMINE;2-pyrimidinemethanamine, AldrichCPR;BCP27503;AKOS009123469;CS-W008578;PB23443;DS-10502;PD049642;SY019710;AM20100741;FT-0646813;FT-0726970;NS00040721;A15793;EN300-149197;J-524135;F2147-1534

Chemical Property of 2-Pyrimidinemethanamine

Chemical Property:

• Vapor Pressure: 0.919mmHg at 25°C
• Refractive Index: 1.557
• Boiling Point: 179.9 °C at 760 mmHg
• Flash Point: 83.7 °C
• PSA: 51.80000
• Density: 1.138 g/cm³
• LogP: 0.63560
• Storage Temp.: 2-8°C(protect from light)
• Solubility.: Chloroform (Sparingly), Methanol (Slightly)
• XLogP3: -0.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 109.063997236
• Heavy Atom Count: 8
• Complexity: 58.7

Purity/Quality:

99.9% ^*data from raw suppliers

2-Pyrimidinemethanamine ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CN=C(N=C1)CN
• Uses: 2-Pyrimidinemethanamine can be prepared to combat abiotic plant stress.

Technology Process of 2-Pyrimidinemethanamine

There total 2 articles about 2-Pyrimidinemethanamine 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: 95.0%

2-cyanopyrimidine (14080-23-0) → 2-aminomethylpyrimidine (75985-45-4)

Guidance literature:

With palladium 10% on activated carbon; hydrogen; In ethanol; for 12h; under 760.051 Torr; Inert atmosphere;

Reference yield: 33.0%

→ 2-aminomethylpyrimidine (75985-45-4)

Guidance literature:

Reference yield: 99.0%

4-{[(3-chloro-4-methoxyphenyl)methyl]amino}-2-[(2S)-2-(hydroxymethyl)pyrrolidin-1-yl]pyrimidine-5-carboxylic acid (330785-84-7) + 2-aminomethylpyrimidine (75985-45-4) → avanafil (330784-47-9)

Guidance literature:

With dicyclohexyl-carbodiimide; 1-hydroxy-1,2,3-benzotriazine-4(3H)-one; In N,N-dimethyl-formamide; at 0 ℃; Temperature;

upstream raw materials:

2-cyanopyrimidine

Downstream raw materials:

avanafil

4-(3-chloro-4-methoxybenzylamino)-5-[N-(2-pyrimidinylmethyl)carbamoyl]-6-methoxy-2-methylthiopyrimidine

N-(4-fluorophenyl)-N'-phenyl-N-(pyrimidin-2-ylmethyl)-1,3,5-triazine-2,4,6-triamine

C₂₅H₂₄N₆O₂

Refernces

• 1、 -. "PROCESS FOR PRODUCING OPTICALLY ACTIVE SECONDARY ALCOHOL". Page/Page column 0148; 0149. . Retrieved 2015/02/19.
• 2、 -. "COMPOUNDS AND RELATED COMPOSITIONS AND METHODS OF USE". Page/Page column 42. . Retrieved 2013/03/26.