tert-butyl 4-oxo-2,3-dihydroquinoline-1-carboxylate


Chemical Name: tert-butyl 4-oxo-2,3-dihydroquinoline-1-carboxylate
CAS Number: 179898-00-1
Product Number: AG0027CP(AGN-PC-0434FC)
Synonyms:
MDL No: MFCD10697721
Molecular Formula: C14H17NO3
Molecular Weight: 247.2897

Identification/Properties


Properties
BP:
360.706°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
247.294g/mol
XLogP3:
2.2
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
247.121g/mol
Monoisotopic Mass:
247.121g/mol
Topological Polar Surface Area:
46.6A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
345
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
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
Precautionary Statements:
P264-P270-P301+P312-P330
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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