Home Other Building Blocks Octahydropyrrolo[1,2-a][1,4]diazepin-5-one

Octahydropyrrolo[1,2-a][1,4]diazepin-5-one

CAS No.:
1000577-71-8
Catalog Number:
AG0000RR
Molecular Formula:
C8H14N2O
Molecular Weight:
154.2096
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
100mg
97%
1 week
United States
$382
- +
250mg
97%
1 week
United States
$613
- +
1g
97%
1 week
United States
$1762
- +
5g
97%
1 week
United States
$5209
- +
Product Description
Catalog Number:
AG0000RR
Chemical Name:
Octahydropyrrolo[1,2-a][1,4]diazepin-5-one
CAS Number:
1000577-71-8
Molecular Formula:
C8H14N2O
Molecular Weight:
154.2096
MDL Number:
MFCD09878662
IUPAC Name:
1,2,3,4,7,8,9,9a-octahydropyrrolo[1,2-a][1,4]diazepin-5-one
InChI:
InChI=1S/C8H14N2O/c11-8-3-4-9-6-7-2-1-5-10(7)8/h7,9H,1-6H2
InChI Key:
AKLGFFJQGYPBOC-UHFFFAOYSA-N
SMILES:
O=C1CCNCC2N1CCC2
Properties
Complexity:
170  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
154.111g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
154.213g/mol
Monoisotopic Mass:
154.111g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
-0.4  
Properties