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4273-88-5 | 2-ACETOACETAMIDO-6-ETHOXYBENZOTHIAZOLE
CAS No: 4273-88-5 Catalog No: AG00BXLD MDL No:MFCD00022862
Product Description
Catalog Number:
AG00BXLD
Chemical Name:
2-ACETOACETAMIDO-6-ETHOXYBENZOTHIAZOLE
CAS Number:
4273-88-5
MDL Number:
MFCD00022862
IUPAC Name:
N-(6-ethoxy-1,3-benzothiazol-2-yl)-3-oxobutanamide
InChI:
InChI=1S/C13H14N2O3S/c1-3-18-9-4-5-10-11(7-9)19-13(14-10)15-12(17)6-8(2)16/h4-5,7H,3,6H2,1-2H3,(H,14,15,17)
InChI Key:
GXFGVXXEQKKDGE-UHFFFAOYSA-N
EC Number:
224-269-0
NSC Number:
59998
Properties
Complexity:
351
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
278.073g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
278.326g/mol
Monoisotopic Mass:
278.073g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
96.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3
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