ethyl N-(1-oxo-3,4-dihydro-2H-isoquinolin-7-yl)carbamate


Chemical Name: ethyl N-(1-oxo-3,4-dihydro-2H-isoquinolin-7-yl)carbamate
CAS Number: 885273-79-0
Product Number: AG0047MF(AGN-PC-09LF5R)
Synonyms:
MDL No:
Molecular Formula: C12H14N2O3
Molecular Weight: 234.2512

Identification/Properties


Computed Properties
Molecular Weight:
234.255g/mol
XLogP3:
1.2
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
234.1g/mol
Monoisotopic Mass:
234.1g/mol
Topological Polar Surface Area:
67.4A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
306
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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