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Home > Nitro Compounds > 60338-58-1
60338-58-1 | 3-methyl-N-(5-nitro-1,3-thiazol-2-yl)benzamide
CAS No: 60338-58-1 Catalog No: AG00IRW7 MDL No:MFCD01213546
Product Description
Catalog Number:
AG00IRW7
Chemical Name:
3-methyl-N-(5-nitro-1,3-thiazol-2-yl)benzamide
CAS Number:
60338-58-1
Molecular Formula:
C11H9N3O3S
Molecular Weight:
263.2725
MDL Number:
MFCD01213546
IUPAC Name:
3-methyl-N-(5-nitro-1,3-thiazol-2-yl)benzamide
InChI:
InChI=1S/C11H9N3O3S/c1-7-3-2-4-8(5-7)10(15)13-11-12-6-9(18-11)14(16)17/h2-6H,1H3,(H,12,13,15)
InChI Key:
ZLHUKSCALPDKMF-UHFFFAOYSA-N
SMILES:
Cc1cccc(c1)C(=O)Nc1ncc(s1)[N+](=O)[O-]
Properties
Complexity:
334
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
263.036g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
5
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
263.271g/mol
Monoisotopic Mass:
263.036g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
116A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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