Home Nitros (E)-N-(2-Methylpropyl)-N'-(4-nitrophenyl)-1H-1,2,3-benzotriazole-1-carboximidamide

(E)-N-(2-Methylpropyl)-N'-(4-nitrophenyl)-1H-1,2,3-benzotriazole-1-carboximidamide

CAS No.:
305862-29-7
Catalog Number:
AG01EUTK
Molecular Formula:
C17H18N6O2
Molecular Weight:
338.3638
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5mg
90%
1 week
United States
$207
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Product Description
Catalog Number:
AG01EUTK
Chemical Name:
(E)-N-(2-Methylpropyl)-N'-(4-nitrophenyl)-1H-1,2,3-benzotriazole-1-carboximidamide
CAS Number:
305862-29-7
Molecular Formula:
C17H18N6O2
Molecular Weight:
338.3638
MDL Number:
MFCD01961341
IUPAC Name:
N'-(2-methylpropyl)-N-(4-nitrophenyl)benzotriazole-1-carboximidamide
InChI:
InChI=1S/C17H18N6O2/c1-12(2)11-18-17(19-13-7-9-14(10-8-13)23(24)25)22-16-6-4-3-5-15(16)20-21-22/h3-10,12H,11H2,1-2H3,(H,18,19)
InChI Key:
WEHUETAMWOXKMV-UHFFFAOYSA-N
SMILES:
CC(CN/C(=N\c1ccc(cc1)[N+](=O)[O-])/n1nnc2c1cccc2)C
Properties
Complexity:
484  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
338.149g/mol
Formal Charge:
0
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
338.371g/mol
Monoisotopic Mass:
338.149g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
101A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Properties