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Home Other Building Blocks 1-benzyl-N'-hydroxy-1H-1,2,3-triazole-4-carboximidamide

1-benzyl-N'-hydroxy-1H-1,2,3-triazole-4-carboximidamide

CAS No.:
1255791-11-7
Catalog Number:
AG01BBDK
Molecular Formula:
C10H11N5O
Molecular Weight:
217.2272
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Product Description
Catalog Number:
AG01BBDK
Chemical Name:
1-benzyl-N'-hydroxy-1H-1,2,3-triazole-4-carboximidamide
CAS Number:
1255791-11-7
Molecular Formula:
C10H11N5O
Molecular Weight:
217.2272
MDL Number:
MFCD17780206
IUPAC Name:
1-benzyl-N'-hydroxytriazole-4-carboximidamide
InChI:
InChI=1S/C10H11N5O/c11-10(13-16)9-7-15(14-12-9)6-8-4-2-1-3-5-8/h1-5,7,16H,6H2,(H2,11,13)
InChI Key:
RKTJREFXTKAGMC-UHFFFAOYSA-N
SMILES:
ON=C(c1nnn(c1)Cc1ccccc1)N
Properties
Complexity:
252  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
217.096g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
217.232g/mol
Monoisotopic Mass:
217.096g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
89.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8  
Properties