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Home Carbonyls N,N'-Bis(benzyloxycarbonyl)-1h-pyrazole-1-carboxamidine

N,N'-Bis(benzyloxycarbonyl)-1h-pyrazole-1-carboxamidine

CAS No.:
152120-55-3
Catalog Number:
AG00APP1
Molecular Formula:
C20H18N4O4
Molecular Weight:
378.3813
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$13
- +
5g
98%
In Stock USA
United States
$44
- +
25g
98%
In Stock USA
United States
$175
- +
100g
98%
In Stock USA
United States
$563
- +
Product Description
Catalog Number:
AG00APP1
Chemical Name:
N,N'-Bis(benzyloxycarbonyl)-1h-pyrazole-1-carboxamidine
CAS Number:
152120-55-3
Molecular Formula:
C20H18N4O4
Molecular Weight:
378.3813
MDL Number:
MFCD02092983
IUPAC Name:
benzyl (NZ)-N-[phenylmethoxycarbonylamino(pyrazol-1-yl)methylidene]carbamate
InChI:
InChI=1S/C20H18N4O4/c25-19(27-14-16-8-3-1-4-9-16)22-18(24-13-7-12-21-24)23-20(26)28-15-17-10-5-2-6-11-17/h1-13H,14-15H2,(H,22,23,25,26)
InChI Key:
NRBUVVTTYMTSKM-UHFFFAOYSA-N
SMILES:
OC(=NC(=NC(=O)OCc1ccccc1)n1cccn1)OCc1ccccc1
Properties
Complexity:
542  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
378.133g/mol
Formal Charge:
0
Heavy Atom Count:
28  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
378.388g/mol
Monoisotopic Mass:
378.133g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
94.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.1  
Properties