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Home Other Building Blocks (4-Pyridylthio)acetic acid

(4-Pyridylthio)acetic acid

CAS No.:
10351-19-6
Catalog Number:
AG003BWQ
Molecular Formula:
C7H7NO2S
Molecular Weight:
169.2010
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$13
- +
5g
95%
In Stock USA
United States
$25
- +
25g
95%
In Stock USA
United States
$44
- +
100g
95%
In Stock USA
United States
$94
- +
500g
95%
In Stock USA
United States
$375
- +
Product Description
Catalog Number:
AG003BWQ
Chemical Name:
(4-Pyridylthio)acetic acid
CAS Number:
10351-19-6
Molecular Formula:
C7H7NO2S
Molecular Weight:
169.2010
MDL Number:
MFCD00006424
IUPAC Name:
2-pyridin-4-ylsulfanylacetic acid
InChI:
InChI=1S/C7H7NO2S/c9-7(10)5-11-6-1-3-8-4-2-6/h1-4H,5H2,(H,9,10)
InChI Key:
PGUPJAPHYIEKLT-UHFFFAOYSA-N
SMILES:
OC(=O)CSc1ccncc1
EC Number:
233-765-6
Properties
Complexity:
134  
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  
Literature
Title Journal
Poly[aqua-bis-[μ(2)-2-(pyridin-4-ylsulfan-yl)acetato]-zinc]. Acta crystallographica. Section E, Structure reports online 20110701
Tetra-aqua-bis-[2-(4-pyridyl-sulfan-yl)acetato-κN]nickel(II). Acta crystallographica. Section E, Structure reports online 20110601
Monoclinic polymorph of trans-tetra-aquabis-[(4-pyridylsulfanyl)-acetato-κN]cobalt(II). Acta crystallographica. Section E, Structure reports online 20080801
Properties