Home Other Building Blocks octahydrocyclopenta[c]pyrrol-1-one

octahydrocyclopenta[c]pyrrol-1-one

CAS No.:
56593-76-1
Catalog Number:
AG01C2W8
Molecular Formula:
C7H11NO
Molecular Weight:
125.1683
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Product Description
Catalog Number:
AG01C2W8
Chemical Name:
octahydrocyclopenta[c]pyrrol-1-one
CAS Number:
56593-76-1
Molecular Formula:
C7H11NO
Molecular Weight:
125.1683
IUPAC Name:
2,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-3-one
InChI:
InChI=1S/C7H11NO/c9-7-6-3-1-2-5(6)4-8-7/h5-6H,1-4H2,(H,8,9)
InChI Key:
RLEPMHBHXGEBBX-UHFFFAOYSA-N
SMILES:
O=C1NCC2C1CCC2
Properties
Complexity:
144  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
125.084g/mol
Formal Charge:
0
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
125.171g/mol
Monoisotopic Mass:
125.084g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  
Properties