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Home Other Building Blocks 2'-Methylacetoacetanilide (AAOT)

2'-Methylacetoacetanilide (AAOT)

CAS No.:
93-68-5
Catalog Number:
AG003HOC
Molecular Formula:
C11H13NO2
Molecular Weight:
191.2264
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
98%
In Stock USA
United States
$33
- +
25g
98%
In Stock USA
United States
$41
- +
100g
98%
In Stock USA
United States
$60
- +
500g
98%
In Stock USA
United States
$108
- +
Product Description
Catalog Number:
AG003HOC
Chemical Name:
2'-Methylacetoacetanilide (AAOT)
CAS Number:
93-68-5
Molecular Formula:
C11H13NO2
Molecular Weight:
191.2264
MDL Number:
MFCD00008782
IUPAC Name:
N-(2-methylphenyl)-3-oxobutanamide
InChI:
InChI=1S/C11H13NO2/c1-8-5-3-4-6-10(8)12-11(14)7-9(2)13/h3-6H,7H2,1-2H3,(H,12,14)
InChI Key:
TVZIWRMELPWPPR-UHFFFAOYSA-N
SMILES:
O=C(Nc1ccccc1C)CC(=O)C
EC Number:
202-267-0
UNII:
MCN1GV8J3R
NSC Number:
7655
Properties
Complexity:
225  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
191.095g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
191.23g/mol
Monoisotopic Mass:
191.095g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
46.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Literature
Title Journal
Developing biologically active compounds having efficient DNA binding and cleavage activity: spectroscopic investigation. Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20120701
Synthesis, spectral, catalytic and antimicrobial studies of PPh3/AsPh3 complexes of Ru(II) with dibasic tridentate O, N, S donor ligands. Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20070901
Properties