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


Chemical Name: ethyl 1,2,3,4-tetrahydroisoquinoline-1-carboxylate;hydrochloride
CAS Number: 103733-33-1
Product Number: AG0085FN(AGN-PC-079VBD)
Synonyms:
MDL No:
Molecular Formula: C12H16ClNO2
Molecular Weight: 241.7139

Identification/Properties


Computed Properties
Molecular Weight:
241.715g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
241.087g/mol
Monoisotopic Mass:
241.087g/mol
Topological Polar Surface Area:
38.3A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
230
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:
H315-H319-H335
Precautionary Statements:
P233-P260-P261-P264-P271-P280-P302+P352-P304-P304+P340-P305+P351+P338-P312-P321-P332+P313-P337+P313-P340-P362-P403-P403+P233-P405-P501
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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