5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine

Base Information

• Chemical Name: 5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine
• CAS No.: 1501-13-9
• Molecular Formula: C12H10 N4
• Molecular Weight: 210.238
• Hs Code.: 2933990090
• NSC Number: 86922
• DSSTox Substance ID: DTXSID70418299
• Mol file: 1501-13-9.mol

Synonyms:5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine;1501-13-9;7-PHENYL-2,4,9-TRIAZABICYCLO[4.3.0]NONA-1,3,5,7-TETRAEN-5-AMINE;NSC86922;7-Deaza-7-phenyladenine;SCHEMBL7021288;DTXSID70418299;NQKXWFXNLQYDHZ-UHFFFAOYSA-N;NSC-86922;5-Phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl-amine;A1-41953

Chemical Property of 5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• PSA: 67.59000
• Density: 1.348g/cm³
• LogP: 2.78830
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 210.090546336
• Heavy Atom Count: 16
• Complexity: 239

Purity/Quality:

99% ^*data from raw suppliers

5-PHENYL-7H-PYRROLO[2,3-D]PYRIMIDIN-4-AMINE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C2=CNC3=NC=NC(=C23)N

Technology Process of 5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-amine

There total 13 articles about 5-phenyl-7H-pyrrolo[2,3-d]pyrimidin-4-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:

C13H12N4O → 4-amino-5-phenyl-7H-pyrrolo[2,3-d]pyrimidine (1501-13-9)

Guidance literature:

With ammonium hydroxide; In methanol; at 20 ℃; for 12h;

DOI:10.1055/s-0036-1588443

Reference yield:

N-[3-cyano-4-(4-methoxy-phenyl)-1H-pyrrol-2-yl]-formamidine + sodium ethanolate (141-52-6) → 4-amino-5-phenyl-7H-pyrrolo[2,3-d]pyrimidine (1501-13-9)

Guidance literature:

In ethanol;

Reference yield:

N-(3-cyano-4-phenyl-1H-pyrrol-2-yl)-formamidine (344359-57-5,1593-20-0) → 4-amino-5-phenyl-7H-pyrrolo[2,3-d]pyrimidine (1501-13-9)

Guidance literature:

With sodium ethanolate; In ethanol; at 80 ℃;

DOI:10.1016/S0960-894X(01)00079-8

upstream raw materials:

N-(3-cyano-4-phenyl-1H-pyrrol-2-yl)-formamidine

N-phenacylacetamide

2-azido-1-phenylethan-1-one

2-amino-3-cyano-4-phenylpyrrole

Downstream raw materials:

4-amino-5-phenyl-7-(benzoyloxyethoxymethyl)pyrrolo[2,3-d]pyrimidine

4-amino-5-phenyl-7-(5-deoxy-2,3-O-isopropylidenyl-β-D-ribofuranosyl)pyrrolo[2,3-d]pyrimidine

2-(4-amino-5-phenyl-pyrrolo[2,3-d]pyrimidin-7-ylmethoxy)-ethanol

4-amino-5-phenyl-7-(tert-butyldimethylsilyloxyethoxymethyl)pyrrolo[2,3-d]pyrimidine

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