Home Nitriles 2-Ethoxy-4-hydroxythiazole-5-carbonitrile

2-Ethoxy-4-hydroxythiazole-5-carbonitrile

CAS No.:
59965-53-6
Catalog Number:
AG003H60
Molecular Formula:
C6H6N2O2S
Molecular Weight:
170.1890
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
>95%
In Stock USA
United States
$186
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Product Description
Catalog Number:
AG003H60
Chemical Name:
2-Ethoxy-4-hydroxythiazole-5-carbonitrile
CAS Number:
59965-53-6
Molecular Formula:
C6H6N2O2S
Molecular Weight:
170.1890
MDL Number:
MFCD21641303
IUPAC Name:
2-ethoxy-4-hydroxy-1,3-thiazole-5-carbonitrile
InChI:
InChI=1S/C6H6N2O2S/c1-2-10-6-8-5(9)4(3-7)11-6/h9H,2H2,1H3
InChI Key:
PMGJBSHMCHYQKW-UHFFFAOYSA-N
SMILES:
CCOc1nc(c(s1)C#N)O
Properties
Complexity:
179  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
170.015g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
170.186g/mol
Monoisotopic Mass:
170.015g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
94.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties