Benzenepropanoic acid, b-(aminomethyl)-4-chloro-


Chemical Name: Benzenepropanoic acid, b-(aminomethyl)-4-chloro-
CAS Number: 1134-47-0
Product Number: AG003NYH(AGN-PC-0P4VD2)
Synonyms:
MDL No:
Molecular Formula: C10H12ClNO2
Molecular Weight: 213.6608

Identification/Properties


Properties
MP:
208-210°C
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Refractive Index:
1.5500 (estimate)
Solubility:
1 M HCl: 50 mg/mL
Computed Properties
Molecular Weight:
213.661g/mol
XLogP3:
-1
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
4
Exact Mass:
213.056g/mol
Monoisotopic Mass:
213.056g/mol
Topological Polar Surface Area:
63.3A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
191
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:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Danger
UN#:
2811
Hazard Statements:
H301-H315-H319-H317-H334
Precautionary Statements:
P261-P264-P280-P342+P311-P304+P340-P301+P310+P330
Class:
6.1
Packing Group:

NMR Spectrum


Other Analytical Data


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