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2621-62-7 | Acetamide, N-(2,5-dichlorophenyl)-
CAS No: 2621-62-7 Catalog No: AG002SAA MDL No:MFCD00018519
Product Description
Catalog Number:
AG002SAA
Chemical Name:
Acetamide, N-(2,5-dichlorophenyl)-
CAS Number:
2621-62-7
Molecular Formula:
C8H7Cl2NO
Molecular Weight:
204.0533
MDL Number:
MFCD00018519
IUPAC Name:
N-(2,5-dichlorophenyl)acetamide
InChI:
InChI=1S/C8H7Cl2NO/c1-5(12)11-8-4-6(9)2-3-7(8)10/h2-4H,1H3,(H,11,12)
InChI Key:
ICZFWTSENFTULW-UHFFFAOYSA-N
SMILES:
CC(=O)Nc1cc(Cl)ccc1Cl
EC Number:
220-062-4
NSC Number:
28454
Properties
Complexity:
174
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
202.99g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
204.05g/mol
Monoisotopic Mass:
202.99g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
Literature
| Title | Journal |
|---|---|
| Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis. | Bioorganic & medicinal chemistry letters 20101101 |
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