tert-butyl (3aR,6aS)-2-benzyl-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carboxylate


Chemical Name: tert-butyl (3aR,6aS)-2-benzyl-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carboxylate
CAS Number: 186202-73-3
Product Number: AG00ANJB(AGN-PC-0K6A6N)
Synonyms:
MDL No:
Molecular Formula: C18H26N2O2
Molecular Weight: 302.4112

Identification/Properties


Computed Properties
Molecular Weight:
302.418g/mol
XLogP3:
2.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
4
Exact Mass:
302.199g/mol
Monoisotopic Mass:
302.199g/mol
Topological Polar Surface Area:
32.8A^2
Heavy Atom Count:
22
Formal Charge:
0
Complexity:
384
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
2
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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