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Home Other Building Blocks 6-Chloroacetyl-2-benzoxazolinone

6-Chloroacetyl-2-benzoxazolinone

CAS No.:
54903-10-5
Catalog Number:
AG003N6A
Molecular Formula:
C9H6ClNO3
Molecular Weight:
211.6018
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$110
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Product Description
Catalog Number:
AG003N6A
Chemical Name:
6-Chloroacetyl-2-benzoxazolinone
CAS Number:
54903-10-5
Molecular Formula:
C9H6ClNO3
Molecular Weight:
211.6018
MDL Number:
MFCD01664322
IUPAC Name:
6-(2-chloroacetyl)-3H-1,3-benzoxazol-2-one
InChI:
InChI=1S/C9H6ClNO3/c10-4-7(12)5-1-2-6-8(3-5)14-9(13)11-6/h1-3H,4H2,(H,11,13)
InChI Key:
KOOWFDRPKXUCRF-UHFFFAOYSA-N
SMILES:
ClCC(=O)c1ccc2c(c1)oc(=O)[nH]2
Properties
Complexity:
269  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
211.004g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
211.601g/mol
Monoisotopic Mass:
211.004g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
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