3-Isoquinolinecarboxylicacid, 1,2,3,4-tetrahydro-2-methyl-, hydrochloride (1:1)


Chemical Name: 3-Isoquinolinecarboxylicacid, 1,2,3,4-tetrahydro-2-methyl-, hydrochloride (1:1)
CAS Number: 20335-68-6
Product Number: AG0028UV(AGN-PC-07XS9C)
Synonyms:
MDL No:
Molecular Formula: C11H14ClNO2
Molecular Weight: 227.6874

Identification/Properties


Properties
Storage:
Keep in dry area;Room Temperature;
Computed Properties
Molecular Weight:
227.688g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
227.071g/mol
Monoisotopic Mass:
227.071g/mol
Topological Polar Surface Area:
40.5A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
229
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#:
-
Hazard Statements:
H319
Precautionary Statements:
P264-P280-P305+P351+P338-P337+P313
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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