Cas no 5453-10-1 (2-chloro-7-methyl-7H-Purin-6-amine)
5453-10-1 structure
Product Name:2-chloro-7-methyl-7H-Purin-6-amine
CAS No:5453-10-1
MF:C6H6ClN5
MW:183.598338603973
CID:382816
PubChem ID:227462
Update Time:2025-04-19
2-chloro-7-methyl-7H-Purin-6-amine Chemical and Physical Properties
Names and Identifiers
-
- 2-chloro-7-methyl-7H-Purin-6-amine
- 6-AMINO-2-CHLORO-7-METHYLPURINE
- 7H-Purin-6-amine,2-chloro-7-methyl-
- 2-Chlor-6-amino-7-methylpurin
- 2-Chlor-7-methyl-7H-purin-6-ylamin
- 2-chlor-7-methyl-adenin
- 2-Chloro-6-amino-7-methylpurine
- 2-chloro-7-methyl-7H-purin-6-ylamine
- 2-chloro-7-methyladenine
- DTXSID10280912
- 5453-10-1
- 2-chloro-7-methylpurin-6-amine
- 2-Chloro-6-amino-7-methyl-purine
- NSC19059
- 7-Methyl-6-amino-2-chlorpurin
- AKOS006275376
- FT-0718901
- NSC-19059
- SCHEMBL11556607
- CHEMBL4090587
- AG-687/33257040
-
- Inchi： 1S/C6H6ClN5/c1-12-2-9-5-3(12)4(8)10-6(7)11-5/h2H,1H3,(H2,8,10,11)
- InChI Key： COUCYQIHVPHAEM-UHFFFAOYSA-N
- SMILES： ClC1N=C(C2=C(N=1)N=CN2C)N
Computed Properties
- Exact Mass: 183.03100
- Monoisotopic Mass: 183.0311729g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 1
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 12
- Rotatable Bond Count: 0
- Complexity: 177
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 0.7
- Topological Polar Surface Area: 69.6?2
Experimental Properties
- PSA: 69.62000
- LogP: 1.18010
2-chloro-7-methyl-7H-Purin-6-amine Related Literature
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Matthew J. Gaunt,Jinquan Yu,Jonathan B. Spencer Chem. Commun., 2001, 1844-1845
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Eléonore Resongles,Corinne Casiot,Fran?oise Elbaz-Poulichet,Rémi Freydier,Odile Bruneel,Christine Piot,Sophie Delpoux,Aurélie Volant,Angélique Desoeuvre Environ. Sci.: Processes Impacts, 2013,15, 1536-1544
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Pavel Karásek,Jakub Grym,Michal Roth,Josef Planeta,Franti?ek Foret Lab Chip, 2015,15, 311-318
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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