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Home Other Building Blocks (Pyridin-2-ylthio)acetic acid

(Pyridin-2-ylthio)acetic acid

CAS No.:
10002-29-6
Catalog Number:
AG0000BG
Molecular Formula:
C7H7NO2S
Molecular Weight:
169.2010
Pack Size
Purity
Availability
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Quantity
  
1g
95%
In Stock USA
United States
$168
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Product Description
Catalog Number:
AG0000BG
Chemical Name:
(Pyridin-2-ylthio)acetic acid
CAS Number:
10002-29-6
Molecular Formula:
C7H7NO2S
Molecular Weight:
169.2010
MDL Number:
MFCD00276114
IUPAC Name:
2-pyridin-2-ylsulfanylacetic acid
InChI:
InChI=1S/C7H7NO2S/c9-7(10)5-11-6-3-1-2-4-8-6/h1-4H,5H2,(H,9,10)
InChI Key:
IGJFLPNTKLFHMW-UHFFFAOYSA-N
SMILES:
OC(=O)CSc1ccccn1
Properties
Complexity:
140  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
169.02g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
169.198g/mol
Monoisotopic Mass:
169.02g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
75.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Literature
Title Journal
2-(2-Pyridylsulfan-yl)acetic acid. Acta crystallographica. Section E, Structure reports online 20100101
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties