Home Other Building Blocks tert-butyl N-{octahydrocyclopenta[c]pyrrol-3a-yl}carbamate

tert-butyl N-{octahydrocyclopenta[c]pyrrol-3a-yl}carbamate

CAS No.:
1211595-89-9
Catalog Number:
AG01B44C
Molecular Formula:
C12H22N2O2
Molecular Weight:
226.3153
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Product Description
Catalog Number:
AG01B44C
Chemical Name:
tert-butyl N-{octahydrocyclopenta[c]pyrrol-3a-yl}carbamate
CAS Number:
1211595-89-9
Molecular Formula:
C12H22N2O2
Molecular Weight:
226.3153
MDL Number:
MFCD12755314
IUPAC Name:
tert-butyl N-(2,3,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrol-3a-yl)carbamate
InChI:
InChI=1S/C12H22N2O2/c1-11(2,3)16-10(15)14-12-6-4-5-9(12)7-13-8-12/h9,13H,4-8H2,1-3H3,(H,14,15)
InChI Key:
IOJANHDPMBVRLJ-UHFFFAOYSA-N
SMILES:
O=C(NC12CCCC2CNC1)OC(C)(C)C
Properties
Complexity:
285  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
226.168g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
226.32g/mol
Monoisotopic Mass:
226.168g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
50.4A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
1.3  
Properties