6-phenylmethoxycarbonyl-6-azaspiro[2.5]octane-2-carboxylic acid


Chemical Name: 6-phenylmethoxycarbonyl-6-azaspiro[2.5]octane-2-carboxylic acid
CAS Number: 147610-85-3
Product Number: AG001F1B(AGN-PC-09PZHX)
Synonyms:
MDL No:
Molecular Formula: C16H18NO4-
Molecular Weight: 288.3184

Identification/Properties


Computed Properties
Molecular Weight:
289.331g/mol
XLogP3:
1.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
4
Exact Mass:
289.131g/mol
Monoisotopic Mass:
289.131g/mol
Topological Polar Surface Area:
66.8A^2
Heavy Atom Count:
21
Formal Charge:
0
Complexity:
409
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
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#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P280-P301+P312-P302+P352-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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