Home Halogens 3-chloro-N-[1-(N'-hydroxycarbamimidoyl)-1-methylethyl]benzamide

3-chloro-N-[1-(N'-hydroxycarbamimidoyl)-1-methylethyl]benzamide

CAS No.:
1286215-09-5
Catalog Number:
AG01AJQ1
Molecular Formula:
C11H14ClN3O2
Molecular Weight:
255.7008
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Product Description
Catalog Number:
AG01AJQ1
Chemical Name:
3-chloro-N-[1-(N'-hydroxycarbamimidoyl)-1-methylethyl]benzamide
CAS Number:
1286215-09-5
Molecular Formula:
C11H14ClN3O2
Molecular Weight:
255.7008
MDL Number:
MFCD16373841
IUPAC Name:
N-(1-amino-1-hydroxyimino-2-methylpropan-2-yl)-3-chlorobenzamide
InChI:
InChI=1S/C11H14ClN3O2/c1-11(2,10(13)15-17)14-9(16)7-4-3-5-8(12)6-7/h3-6,17H,1-2H3,(H2,13,15)(H,14,16)
InChI Key:
BQPUUXXJKSWMNA-UHFFFAOYSA-N
SMILES:
ON=C(C(NC(=O)c1cccc(c1)Cl)(C)C)N
Properties
Complexity:
318  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.077g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
255.702g/mol
Monoisotopic Mass:
255.077g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
87.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
1.6  
Properties