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18619-18-6,MFCD01910097
Catalog No.:AA00AKXG

18619-18-6 | 2-((2-Chlorophenyl)thio)acetic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
98%
1 week  
$141.00   $99.00
- +
1g
98%
1 week  
$377.00   $264.00
- +
5g
98%
1 week  
$1,321.00   $925.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00AKXG
Chemical Name:
2-((2-Chlorophenyl)thio)acetic acid
CAS Number:
18619-18-6
Molecular Formula:
C8H7ClO2S
Molecular Weight:
202.6580
MDL Number:
MFCD01910097
SMILES:
OC(=O)CSc1ccccc1Cl
NSC Number:
513490
Properties
Properties
 
Form:
Solid  

Computed Properties
 
Complexity:
163  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
XLogP3:
2.7  

Downstream Synthesis Route

[1]Gurumurthy,Rajagopal;Sathiyanarayanan,KulathuIyer;Gopalakrishnan,Mannathusamy[BulletinoftheChemicalSocietyofJapan,1992,vol.65,#4,p.1096-1100]

[1]CurrentPatentAssignee:NOVONORDISKA/S-WO2008/14430,2008,A1Locationinpatent:Page/Pagecolumn47

Literature

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

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SDS
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Tags:18619-18-6 Molecular Formula|18619-18-6 MDL|18619-18-6 SMILES|18619-18-6 2-((2-Chlorophenyl)thio)acetic acid