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Ethyl 2-amino-benzothiazole-6-carboxylate

CAS No.:
50850-93-6
Catalog Number:
AG0034U5
Molecular Formula:
C10H10N2O2S
Molecular Weight:
222.2636
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$13
- +
5g
98%
In Stock USA
United States
$29
- +
25g
98%
In Stock USA
United States
$113
- +
100g
98%
In Stock USA
United States
$344
- +
Product Description
Catalog Number:
AG0034U5
Chemical Name:
Ethyl 2-amino-benzothiazole-6-carboxylate
CAS Number:
50850-93-6
Molecular Formula:
C10H10N2O2S
Molecular Weight:
222.2636
MDL Number:
MFCD00102724
IUPAC Name:
ethyl 2-amino-1,3-benzothiazole-6-carboxylate
InChI:
InChI=1S/C10H10N2O2S/c1-2-14-9(13)6-3-4-7-8(5-6)15-10(11)12-7/h3-5H,2H2,1H3,(H2,11,12)
InChI Key:
VYJSGJXWKSDUSG-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1ccc2c(c1)sc(n2)N
Properties
Complexity:
250  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
222.046g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
222.262g/mol
Monoisotopic Mass:
222.046g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
93.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Literature
Title Journal
catena-Poly[lead(II)-bis-(μ-2-amino-1,3-benzothia-zole-6-carboxyl-ato)]. Acta crystallographica. Section E, Structure reports online 20101201
Ethyl 2-(tert-butoxy-carbonyl-amino)-1,3-benzothia-zole-6-carboxyl-ate. Acta crystallographica. Section E, Structure reports online 20100401
Properties