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Home Carboxes 87-42-3
87-42-3,MFCD00075825
Catalog No.:AA0034A0

87-42-3 | 6-Chloropurine

Pack Size
Purity
Availability
Price(USD)
Quantity
  
5g
98%
in stock  
$6.00   $4.00
- +
10g
98%
in stock  
$8.00   $6.00
- +
25g
98%
in stock  
$12.00   $8.00
- +
100g
98%
in stock  
$32.00   $22.00
- +
500g
98%
in stock  
$106.00   $74.00
- +
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA0034A0
Chemical Name:
6-Chloropurine
CAS Number:
87-42-3
Molecular Formula:
C5H3ClN4
Molecular Weight:
154.5571
MDL Number:
MFCD00075825
SMILES:
Clc1ncnc2c1[nH]cn2
NSC Number:
744
Properties
Properties
 
BP:
449.6 °C at 760 mmHg  
Form:
Solid  
MP:
>300 °C (dec.);(lit.);  
Refractive Index:
1.8430 (estimate)  
Solubility:
5 g/L  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
131  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
XLogP3:
1.2  

Upstream Synthesis Route

[1]JournaloftheAmericanChemicalSociety,1954,vol.76,p.6073,6076

[1]OrganicLetters,2016,vol.18,#1,p.16-19

[2]Patent:WO2018/96159,2018,A1,.Locationinpatent:Paragraph0169-0172

[1]Tetrahedron,2002,vol.58,#15,p.2985-2996

[2]JournalofOrganicChemistry,2018,vol.83,#12,p.6334-6353

[3]JournalofOrganicChemistry,2018,vol.83,#12,p.6334-6353

[4]BioorganicandMedicinalChemistry,2007,vol.15,#9,p.3127-3133

[5]JournalofMedicinalChemistry,2009,vol.52,#22,p.7284-7288

[6]OrganicLetters,2016,vol.18,#1,p.16-19

[1]OrganicLetters,2010,vol.12,#24,p.5724-5727

[2]Synthesis,2012,vol.44,#4,p.610-618

[1]Phytochemistry,2010,vol.71,#7,p.823-830

Downstream Synthesis Route

[1]JournaloftheAmericanChemicalSociety,1956,vol.78,p.1928

[1]JournalofMolecularStructure,2011,vol.994,p.350-359

[2]JournaloftheAmericanChemicalSociety,1956,vol.78,p.3693

[1]JournaloftheAmericanChemicalSociety,1954,vol.76,p.6073,6076

[1]JournaloftheAmericanChemicalSociety,1954,vol.76,p.6073,6076

[1]CollectionofCzechoslovakChemicalCommunications,2001,vol.66,p.1545-1592

[2]JournalofHeterocyclicChemistry,1983,vol.20,p.295-299

Literature

Title: Hwang IY, et al. Detection and mechanisms of formation of S-(6-purinyl)glutathione and 6-mercaptopurine in rats given 6-chloropurine. J Pharmacol Exp Ther. 1993 Jan;264(1):41-6.

Title: Sartorelli AC, et al. Comparative studies on the in vivo action of 6-chloropurine, 6-chloropurine ribonucleoside, and 6-chloro-9-ethylpurine on sarcoma 180 ascites cells. J Pharmacol Exp Ther. 1961 Oct;134:123-8.

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SDS
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