3-Isoquinolinecarboxylic acid, 1,2,3,4-tetrahydro-, hydrochloride, (S)-


Chemical Name: 3-Isoquinolinecarboxylic acid, 1,2,3,4-tetrahydro-, hydrochloride, (S)-
CAS Number: 77497-95-1
Product Number: AG008OYM(AGN-PC-0OI0NM)
Synonyms:
MDL No:
Molecular Formula: C10H10NO2-
Molecular Weight: 176.1919

Identification/Properties


Computed Properties
Molecular Weight:
213.661g/mol
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
213.056g/mol
Monoisotopic Mass:
213.056g/mol
Topological Polar Surface Area:
49.3A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
205
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
1
Undefined Atom Stereocenter Count:
0
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#:
-
Hazard Statements:
H302-H315-H319-H332-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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