ethyl 6-hydroxy-1,2,3,4-tetrahydroisoquinoline-1-carboxylate;hydrochloride


Chemical Name: ethyl 6-hydroxy-1,2,3,4-tetrahydroisoquinoline-1-carboxylate;hydrochloride
CAS Number: 128073-50-7
Product Number: AG000XQZ(AGN-PC-02L6LC)
Synonyms:
MDL No:
Molecular Formula: C12H16ClNO3
Molecular Weight: 257.7133

Identification/Properties


Computed Properties
Molecular Weight:
257.714g/mol
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
257.082g/mol
Monoisotopic Mass:
257.082g/mol
Topological Polar Surface Area:
58.6A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
257
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:
2
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H319-H315-H302-H335
Precautionary Statements:
P261-P304+P340-P405-P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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