(3R)-2-(4-methylbenzoyl)-3,4-dihydro-1H-isoquinoline-3-carboxylate


Chemical Name: (3R)-2-(4-methylbenzoyl)-3,4-dihydro-1H-isoquinoline-3-carboxylate
CAS Number: 436811-20-0
Product Number: AG00D9B0(AGN-PC-0OAF7I)
Synonyms:
MDL No:
Molecular Formula: C18H17NO3
Molecular Weight: 295.3325

Identification/Properties


Computed Properties
Molecular Weight:
295.338g/mol
XLogP3:
2.9
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
295.121g/mol
Monoisotopic Mass:
295.121g/mol
Topological Polar Surface Area:
57.6A^2
Heavy Atom Count:
22
Formal Charge:
0
Complexity:
428
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


NMR Spectrum


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