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Home Other Building Blocks Methyl 3,4-dihydro-3-oxo-2h-1,4-benzothiazine-2-acetate

Methyl 3,4-dihydro-3-oxo-2h-1,4-benzothiazine-2-acetate

CAS No.:
7556-63-0
Catalog Number:
AG008PVA
Molecular Formula:
C11H11NO3S
Molecular Weight:
237.2749
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
≥ 97% (HPLC)
1 week
United States
$71
- +
5g
≥ 97% (HPLC)
1 week
United States
$159
- +
25g
≥ 97% (HPLC)
1 week
United States
$522
- +
Product Description
Catalog Number:
AG008PVA
Chemical Name:
Methyl 3,4-dihydro-3-oxo-2h-1,4-benzothiazine-2-acetate
CAS Number:
7556-63-0
Molecular Formula:
C11H11NO3S
Molecular Weight:
237.2749
MDL Number:
MFCD00087156
IUPAC Name:
methyl 2-(3-oxo-4H-1,4-benzothiazin-2-yl)acetate
InChI:
InChI=1S/C11H11NO3S/c1-15-10(13)6-9-11(14)12-7-4-2-3-5-8(7)16-9/h2-5,9H,6H2,1H3,(H,12,14)
InChI Key:
ZAQAENJTGPJUEZ-UHFFFAOYSA-N
SMILES:
COC(=O)CC1Sc2ccccc2NC1=O
Properties
Complexity:
295  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
237.046g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
237.273g/mol
Monoisotopic Mass:
237.046g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
80.7A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Literature
Title Journal
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties