Home Carboxys tert-Butyl 2-(hydroxymethyl)-7,8-dihydro-4h-pyrazolo[1,5-a][1,4]diazepine-5(6h)-carboxylate

tert-Butyl 2-(hydroxymethyl)-7,8-dihydro-4h-pyrazolo[1,5-a][1,4]diazepine-5(6h)-carboxylate

CAS No.:
1135282-77-7
Catalog Number:
AG0090QO
Molecular Formula:
C13H21N3O3
Molecular Weight:
267.3241
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
95%
In Stock USA
United States
$200
- +
250mg
95%
In Stock USA
United States
$368
- +
1g
95%
In Stock USA
United States
$735
- +
Product Description
Catalog Number:
AG0090QO
Chemical Name:
tert-Butyl 2-(hydroxymethyl)-7,8-dihydro-4h-pyrazolo[1,5-a][1,4]diazepine-5(6h)-carboxylate
CAS Number:
1135282-77-7
Molecular Formula:
C13H21N3O3
Molecular Weight:
267.3241
MDL Number:
MFCD12025827
IUPAC Name:
tert-butyl 2-(hydroxymethyl)-4,6,7,8-tetrahydropyrazolo[1,5-a][1,4]diazepine-5-carboxylate
InChI:
InChI=1S/C13H21N3O3/c1-13(2,3)19-12(18)15-5-4-6-16-11(8-15)7-10(9-17)14-16/h7,17H,4-6,8-9H2,1-3H3
InChI Key:
AXNMURBYQCJANJ-UHFFFAOYSA-N
SMILES:
OCc1nn2c(c1)CN(CCC2)C(=O)OC(C)(C)C
Properties
Complexity:
330  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
267.158g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
267.329g/mol
Monoisotopic Mass:
267.158g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
67.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2  
Properties