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40925-65-3,MFCD09743851
Catalog No.:AA00C8VO

40925-65-3 | 6-Methoxy-2(3h)-benzothiazolone

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$54.00   $38.00
- +
5g
98%
in stock  
$172.00   $121.00
- +
25g
95%
in stock  
$797.00 $558.00
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00C8VO
Chemical Name:
6-Methoxy-2(3h)-benzothiazolone
CAS Number:
40925-65-3
Molecular Formula:
C8H7NO2S
Molecular Weight:
181.2117
MDL Number:
MFCD09743851
SMILES:
COc1ccc2c(c1)sc(=O)[nH]2
Properties
Properties
 
Form:
Solid  
MP:
163-165°C  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
198  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
1  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1.7  

Upstream Synthesis Route

[1]Patent:CN108101863,2018,A,.Locationinpatent:Paragraph0043;0044;0045;0046;0047;0048;0050

[1]TetrahedronLetters,2012,vol.53,#20,p.2511-2513

[1]Patent:US4328235,1982,A,

[1]JournalofMedicinalChemistry,1987,vol.30,#2,p.295-303

[1]Patent:US2108712,1934,,

[2]Fortschr.Teerfarbenfabr.Verw.Industriezweige,vol.22,p.324

[3]Fortschr.Teerfarbenfabr.Verw.Industriezweige,vol.22,p.324

Literature

Title: Inhibitors of cyclic AMP phosphodiesterase. 1. Analogues of cilostamide and anagrelide.

Journal: Journal of medicinal chemistry 19870201

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SDS
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Tags:40925-65-3 Molecular Formula|40925-65-3 MDL|40925-65-3 SMILES|40925-65-3 6-Methoxy-2(3h)-benzothiazolone
Catalog No.: AA00C8VO
40925-65-3,MFCD09743851
40925-65-3 | 6-Methoxy-2(3h)-benzothiazolone
Pack Size： 1g
Purity： 98%
in stock
$54.00 $38.00
Pack Size： 5g
Purity： 98%
in stock
$172.00 $121.00
Pack Size： 25g
Purity： 95%
in stock
$797.00 $558.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00C8VO
Chemical Name: 6-Methoxy-2(3h)-benzothiazolone
CAS Number: 40925-65-3
Molecular Formula: C8H7NO2S
Molecular Weight: 181.2117
MDL Number: MFCD09743851
SMILES: COc1ccc2c(c1)sc(=O)[nH]2
Properties
Form: Solid  
MP: 163-165°C  
Storage: Keep in dry area;2-8℃;  
Complexity: 198  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 12  
Hydrogen Bond Acceptor Count: 3  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 1  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1.7  
Upstream Synthesis Route
463-58-1    7732-36-7    40925-65-3 

[1]Patent:CN108101863,2018,A,.Locationinpatent:Paragraph0043;0044;0045;0046;0047;0048;0050

582319-21-9    40925-65-3 

[1]TetrahedronLetters,2012,vol.53,#20,p.2511-2513

530-62-1    6274-29-9    40925-65-3 

[1]Patent:US4328235,1982,A,

1747-60-0    40925-65-3 

[1]JournalofMedicinalChemistry,1987,vol.30,#2,p.295-303

2182-73-2    40925-65-3 

[1]Patent:US2108712,1934,,

[2]Fortschr.Teerfarbenfabr.Verw.Industriezweige,vol.22,p.324

[3]Fortschr.Teerfarbenfabr.Verw.Industriezweige,vol.22,p.324

Literature fold

Title: Inhibitors of cyclic AMP phosphodiesterase. 1. Analogues of cilostamide and anagrelide.

Journal: Journal of medicinal chemistry19870201

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