Pyrrolo[3,4-b]pyrrole, octahydro-1-(phenylmethyl)-


Chemical Name: Pyrrolo[3,4-b]pyrrole, octahydro-1-(phenylmethyl)-
CAS Number: 132414-50-7
Product Number: AG0010NV(AGN-PC-03TABO)
Synonyms:
MDL No:
Molecular Formula: C13H18N2
Molecular Weight: 202.2954

Identification/Properties


Computed Properties
Molecular Weight:
202.301g/mol
XLogP3:
1.6
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
2
Exact Mass:
202.147g/mol
Monoisotopic Mass:
202.147g/mol
Topological Polar Surface Area:
15.3A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
211
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-H332-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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