(3aR,6aR)-5-Ethoxycarbonyl-1H-hexahydropyrrolo[3,4-b]pyrrole


Chemical Name: (3aR,6aR)-5-Ethoxycarbonyl-1H-hexahydropyrrolo[3,4-b]pyrrole
CAS Number: 948846-39-7
Product Number: AG003BQU(AGN-PC-0WA1ZH)
Synonyms:
MDL No:
Molecular Formula: C9H16N2O2
Molecular Weight: 184.2355

Identification/Properties


Properties
Storage:
Room Temperature;
Computed Properties
Molecular Weight:
184.239g/mol
XLogP3:
0.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
184.121g/mol
Monoisotopic Mass:
184.121g/mol
Topological Polar Surface Area:
41.6A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
208
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
2
Undefined Atom Stereocenter Count:
0
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-P280-P301+P312-P302+P352-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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