H-D-His-OMe2HCl


Chemical Name: H-D-His-OMe2HCl
CAS Number: 4467-54-3
Product Number: AG003CBE(AGN-PC-0WADF5)
Synonyms:
MDL No:
Molecular Formula: C7H13Cl2N3O2
Molecular Weight: 242.1030

Identification/Properties


Properties
MP:
197 °C
BP:
415.4°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Stability:
Hygroscopic
Refractive Index:
-9.0 ° (C=2, H2O)
Computed Properties
Molecular Weight:
242.1g/mol
Hydrogen Bond Donor Count:
4
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
4
Exact Mass:
241.038g/mol
Monoisotopic Mass:
241.038g/mol
Topological Polar Surface Area:
81A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
163
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:
3
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H315-H319
Precautionary Statements:
P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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