Benzoic acid, 3-amino-, ethyl ester, methanesulfonate


Chemical Name: Benzoic acid, 3-amino-, ethyl ester, methanesulfonate
CAS Number: 886-86-2
Product Number: AG0089M0(AGN-PC-0JNWOF)
Synonyms:
MDL No:
Molecular Formula: C10H15NO5S
Molecular Weight: 261.2948

Identification/Properties


Computed Properties
Molecular Weight:
261.292g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
3
Exact Mass:
261.067g/mol
Monoisotopic Mass:
261.067g/mol
Topological Polar Surface Area:
115A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
251
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
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:
H315-H319-H335-H412
Precautionary Statements:
P261-P273-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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