Home Other Building Blocks TERT-BUTYL 7-HYDROXY-7,8-DIHYDRO-4H-PYRAZOLO[1,5-A][1,4]DIAZEPINE-5(6H)-CARBOXYLATE

TERT-BUTYL 7-HYDROXY-7,8-DIHYDRO-4H-PYRAZOLO[1,5-A][1,4]DIAZEPINE-5(6H)-CARBOXYLATE

CAS No.:
1823389-42-9
Catalog Number:
AG01DLJ6
Molecular Formula:
C12H19N3O3
Molecular Weight:
253.2976
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
1 week
United States
$557
- +
Product Description
Catalog Number:
AG01DLJ6
Chemical Name:
TERT-BUTYL 7-HYDROXY-7,8-DIHYDRO-4H-PYRAZOLO[1,5-A][1,4]DIAZEPINE-5(6H)-CARBOXYLATE
CAS Number:
1823389-42-9
Molecular Formula:
C12H19N3O3
Molecular Weight:
253.2976
MDL Number:
MFCD28119049
IUPAC Name:
tert-butyl 7-hydroxy-4,6,7,8-tetrahydropyrazolo[1,5-a][1,4]diazepine-5-carboxylate
InChI:
InChI=1S/C12H19N3O3/c1-12(2,3)18-11(17)14-6-9-4-5-13-15(9)8-10(16)7-14/h4-5,10,16H,6-8H2,1-3H3
InChI Key:
JXWHEDYCAWSYQE-UHFFFAOYSA-N
SMILES:
OC1CN(Cc2n(C1)ncc2)C(=O)OC(C)(C)C
Properties
Complexity:
316  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
253.143g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
253.302g/mol
Monoisotopic Mass:
253.143g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
67.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
0
Properties