L-1,2,3,4-Tetrahydronorharman-3-carboxylic acid


Chemical Name: L-1,2,3,4-Tetrahydronorharman-3-carboxylic acid
CAS Number: 42438-90-4
Product Number: AG00BYRH(AGN-PC-0WADJV)
Synonyms:
MDL No:
Molecular Formula: C12H12N2O2
Molecular Weight: 216.2359

Identification/Properties


Properties
MP:
289 °C (dec.)(lit.)
Storage:
Room Temperature;
Form:
Solid
Solubility:
soluble1.5mg/mL, clear (Solvent: 0.1N HCl:DMSO (1:1); warmed)
Computed Properties
Molecular Weight:
216.24g/mol
XLogP3:
-1.2
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
216.09g/mol
Monoisotopic Mass:
216.09g/mol
Topological Polar Surface Area:
65.1A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
295
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:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
-
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:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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