Product Name

  • Name

    beta-Alanine benzyl ester p-toluenesulfonate salt

  • EINECS
  • CAS No. 27019-47-2
  • Article Data1
  • CAS DataBase
  • Density
  • Solubility very faint turbidity in hot Water
  • Melting Point 138-139 °C
  • Formula C10H13NO2.C7H8NO3
  • Boiling Point 547.2 °C at 760 mmHg
  • Molecular Weight 351.423
  • Flash Point 284.7 °C
  • Transport Information
  • Appearance White to off-white powder
  • Safety
  • Risk Codes
  • Molecular Structure Molecular Structure of 27019-47-2 (beta-Alanine benzyl ester p-toluenesulfonate salt)
  • Hazard Symbols
  • Synonyms Beta-Alanine Benzyl Ester p-Tosylate;β-Ala-OBzl·TosOH;H-β-Alanine benzyl ester tosylate;H-β-Ala-OBzl· p-tosylate;beta-Alanine benzyl ester p-toluenesulfonate;β-Alanine benzyl ester P-toluenesulfonate;
  • PSA 115.07000
  • LogP 4.10140

beta-Alanine benzyl ester-p-toluenesulfonate Chemical Properties

IUPAC Name: benzyl 3-aminopropanoate; 4-methylbenzenesulfonic acid 
Following is the structure of beta-Alanine benzyl ester-p-toluenesulfonate (CAS NO.27019-47-2):
               
Empirical Formula: C17H21NO5S
Molecular Weight: 351.4173 
Flash Point: 284.7 °C 
Storage temp. −20 °C
Melting point: 138-139 °C
Enthalpy of Vaporization: 86.97 kJ/mol
Boiling Point: 547.2 °C at 760 mmHg
Vapour Pressure: 8.32E-13 mmHg at 25 °C 
Appearance of beta-Alanine benzyl ester-p-toluenesulfonate (CAS NO.27019-47-2): White to off-white powder
Product Categories of beta-Alanine benzyl ester-p-toluenesulfonate (CAS NO.27019-47-2): β-Alanine [β-Ala]; Amino ester; A - H; Amino Acids; Modified Amino Acids
Canonical SMILES: CC1=CC=C(C=C1)S(=O)(=O)O.C1=CC=C(C=C1)COC(=O)CCN
InChI: InChI=1S/C10H13NO2.C7H8O3S/c11-7-6-10(12)13-8-9-4-2-1-3-5-9;1-6-2-4-7(5-3-6)11(8,9)10/h1-5H,6-8,11H2;2-5H,1H3,(H,8,9,10)
InChIKey: FRHWYVGCFUQMJR-UHFFFAOYSA-N

beta-Alanine benzyl ester-p-toluenesulfonate Safety Profile

WGK Germany: 3

beta-Alanine benzyl ester-p-toluenesulfonate Specification

 beta-Alanine benzyl ester-p-toluenesulfonate , its cas register number 27019-47-2. It also can be called Benzyl beta-alaninate 4-methylbenzenesulfonate (1:1) .

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