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Home Carbonyls N-(Benzyloxycarbonyl)-1h-pyrazole-1-carboxamidine

N-(Benzyloxycarbonyl)-1h-pyrazole-1-carboxamidine

CAS No.:
152120-62-2
Catalog Number:
AG003SSF
Molecular Formula:
C12H12N4O2
Molecular Weight:
244.2493
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$40
- +
5g
>97%
In Stock USA
United States
$61
- +
Product Description
Catalog Number:
AG003SSF
Chemical Name:
N-(Benzyloxycarbonyl)-1h-pyrazole-1-carboxamidine
CAS Number:
152120-62-2
Molecular Formula:
C12H12N4O2
Molecular Weight:
244.2493
MDL Number:
MFCD00274657
IUPAC Name:
benzyl (NE)-N-[amino(pyrazol-1-yl)methylidene]carbamate
InChI:
InChI=1S/C12H12N4O2/c13-11(16-8-4-7-14-16)15-12(17)18-9-10-5-2-1-3-6-10/h1-8H,9H2,(H2,13,15,17)
InChI Key:
BXUMISWXFKCEIA-UHFFFAOYSA-N
SMILES:
O=C(NC(=N)n1cccn1)OCc1ccccc1
Properties
Complexity:
313  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
244.096g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
244.254g/mol
Monoisotopic Mass:
244.096g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
82.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties