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10017-53-5 | Acetamide, 2-(3-methylphenoxy)-
CAS No: 10017-53-5 Catalog No: AG00015M MDL No:MFCD00191464
Product Description
Catalog Number:
AG00015M
Chemical Name:
Acetamide, 2-(3-methylphenoxy)-
CAS Number:
10017-53-5
Molecular Formula:
C9H11NO2
Molecular Weight:
165.1891
MDL Number:
MFCD00191464
IUPAC Name:
2-(3-methylphenoxy)acetamide
InChI:
InChI=1S/C9H11NO2/c1-7-3-2-4-8(5-7)12-6-9(10)11/h2-5H,6H2,1H3,(H2,10,11)
InChI Key:
GOVBTAZVUFGTFB-UHFFFAOYSA-N
SMILES:
NC(=O)COc1cccc(c1)C
Properties
Complexity:
159
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
165.079g/mol
Formal Charge:
0
Heavy Atom Count:
12
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
165.192g/mol
Monoisotopic Mass:
165.079g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
52.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1
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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