3-((2-Amino-1H-purin-6-yl)thio)propionic acid

Base Information

• Chemical Name: 3-((2-Amino-1H-purin-6-yl)thio)propionic acid
• CAS No.: 93919-44-9
• Molecular Formula: C8H9 N5 O2 S
• Molecular Weight: 239.25436
• European Community (EC) Number: 300-029-1
• DSSTox Substance ID: DTXSID40239892
• Nikkaji Number: J320.478B
• Wikidata: Q83122427
• Mol file: 93919-44-9.mol

Synonyms:93919-44-9;3-((2-Amino-1H-purin-6-yl)thio)propionic acid;EINECS 300-029-1;3-((2-Amino-1H-purin-6-yl)thio)propanoic acid;3-[(2-AMINO-1H-PURIN-6-YL)THIO]PROPANOIC ACID;3-[(2-AMINO-1H-PURIN-6-YL)THIO]PROPIONIC ACID;DTXSID40239892

Chemical Property of 3-((2-Amino-1H-purin-6-yl)thio)propionic acid

Chemical Property:

• Vapor Pressure: 2.03E-23mmHg at 25°C
• Boiling Point: 746.7°Cat760mmHg
• Flash Point: 405.4°C
• PSA: 143.81000
• Density: 1.66g/cm³
• LogP: 0.43200
• XLogP3: -0.2
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 4
• Exact Mass: 239.04769572
• Heavy Atom Count: 16
• Complexity: 267

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=NC2=C(N1)C(=NC(=N2)N)SCCC(=O)O