Home Carboxys Ethyl 4-oxo-5,6,7,8-tetrahydro-4h-pyrazolo[1,5-a][1,4]diazepine-2-carboxylate

Ethyl 4-oxo-5,6,7,8-tetrahydro-4h-pyrazolo[1,5-a][1,4]diazepine-2-carboxylate

CAS No.:
604003-26-1
Catalog Number:
AG00EK0C
Molecular Formula:
C10H13N3O3
Molecular Weight:
223.2285
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$126
- +
250mg
95%
In Stock USA
United States
$210
- +
1g
95%
In Stock USA
United States
$420
- +
5g
95%
In Stock USA
United States
$1260
- +
Product Description
Catalog Number:
AG00EK0C
Chemical Name:
Ethyl 4-oxo-5,6,7,8-tetrahydro-4h-pyrazolo[1,5-a][1,4]diazepine-2-carboxylate
CAS Number:
604003-26-1
Molecular Formula:
C10H13N3O3
Molecular Weight:
223.2285
MDL Number:
MFCD06761751
IUPAC Name:
ethyl 4-oxo-5,6,7,8-tetrahydropyrazolo[1,5-a][1,4]diazepine-2-carboxylate
InChI:
InChI=1S/C10H13N3O3/c1-2-16-10(15)7-6-8-9(14)11-4-3-5-13(8)12-7/h6H,2-5H2,1H3,(H,11,14)
InChI Key:
VXXLFPXJBMIPSZ-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cc2n(n1)CCCNC2=O
Properties
Complexity:
295  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.096g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
223.232g/mol
Monoisotopic Mass:
223.096g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
73.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.5  
Properties