Home Other Building Blocks 2,6-DIMETHYLBENZAMIDE

2,6-DIMETHYLBENZAMIDE

CAS No.:
55321-98-7
Catalog Number:
AG00D86I
Molecular Formula:
C9H11NO
Molecular Weight:
149.1897
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
1 week
United States
$94
- +
5g
97%
1 week
United States
$228
- +
25g
97%
1 week
United States
$587
- +
Product Description
Catalog Number:
AG00D86I
Chemical Name:
2,6-DIMETHYLBENZAMIDE
CAS Number:
55321-98-7
Molecular Formula:
C9H11NO
Molecular Weight:
149.1897
MDL Number:
MFCD00052921
IUPAC Name:
2,6-dimethylbenzamide
InChI:
InChI=1S/C9H11NO/c1-6-4-3-5-7(2)8(6)9(10)11/h3-5H,1-2H3,(H2,10,11)
InChI Key:
NXDXMSTXCYCUGG-UHFFFAOYSA-N
SMILES:
NC(=O)c1c(C)cccc1C
Properties
Complexity:
146  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
149.084g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
149.193g/mol
Monoisotopic Mass:
149.084g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
43.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Literature
Title Journal
Piperazine-based CCR5 antagonists as HIV-1 inhibitors. I: 2(S)-methyl piperazine as a key pharmacophore element. Bioorganic & medicinal chemistry letters 20010820
Properties