Home Other Building Blocks N-(2-BENZOTHIAZOLYL)-ACETOACETAMIDE

N-(2-BENZOTHIAZOLYL)-ACETOACETAMIDE

CAS No.:
4692-94-8
Catalog Number:
AG00DZW7
Molecular Formula:
C11H10N2O2S
Molecular Weight:
234.2743
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
1 week
United States
$352
- +
5g
1 week
United States
$1270
- +
10g
1 week
United States
$1723
- +
25g
1 week
United States
$2566
- +
Product Description
Catalog Number:
AG00DZW7
Chemical Name:
N-(2-BENZOTHIAZOLYL)-ACETOACETAMIDE
CAS Number:
4692-94-8
Molecular Formula:
C11H10N2O2S
Molecular Weight:
234.2743
MDL Number:
MFCD00022861
IUPAC Name:
N-(1,3-benzothiazol-2-yl)-3-oxobutanamide
InChI:
InChI=1S/C11H10N2O2S/c1-7(14)6-10(15)13-11-12-8-4-2-3-5-9(8)16-11/h2-5H,6H2,1H3,(H,12,13,15)
InChI Key:
KRVAVIMTIIEASB-UHFFFAOYSA-N
SMILES:
CC(=O)CC(=O)Nc1nc2c(s1)cccc2
UNII:
6LYP4R9QY6
NSC Number:
86136
Properties
Complexity:
296  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
234.046g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
234.273g/mol
Monoisotopic Mass:
234.046g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
87.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Properties