Benzyl glycinate 4-methylbenzenesulfonate (1:1) | CAS No. 1738-76-7

Benzyl glycinate 4-methylbenzenesulfonate (1:1)

Basic Information

CAS Number

1738-76-7

Molecular Formula

C16H19NO5S

Molecular Weight

337.4 g/mol

AD

Basic Physical Properties

Physical State

Powder

Melting Point

132.0 to 136.0 deg-C

Boiling Point

245.5°C at 760 mmHg

Water Solubility

almost transparency

Solubility

methanol: 0.1 g/mL, clear

CC1=CC=C(C=C1)S(=O)(=O)O.C1=CC=C(C=C1)COC(=O)CN

InChI

InChI=1S/C9H11NO2.C7H8O3S/c10-6-9(11)12-7-8-4-2-1-3-5-8;1-6-2-4-7(5-3-6)11(8,9)10/h1-5H,6-7,10H2;2-5H,1H3,(H,8,9,10)

InChIKey

WJKJXKRHMUXQSL-UHFFFAOYSA-N

LogP

1.9302199999999998

Topological Polar Surface Area

106.69000000000001 Ų

Hydrogen Bond Donor/Acceptor

3 / 6

Complexity

348

Safety Information

View Safety Information

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral
H315 Causes skin irritation
Skin corrosion/irritation
H319 Causes serious eye irritation
Serious eye damage/eye irritation
H335 May cause respiratory irritation
Specific target organ toxicity, single exposure; Respiratory tract irritation

Synonyms & References

English

  • Gly-OBzl TosOH
  • O-Benzylglycine toluene-p-sulphonate
  • benzyl 2-aminoacetate; 4-methylbenzenesulfonic acid;H-Gly-OBzl.TosOH
  • Benzyl 2-Aminoacetate 4-Methylbenzenesulfonate
  • glycine benzyl ester-p-toluenesulfonic acid salt
  • AM81794
  • Benzyl glycinate 4-methylbenzenesulfonate salt
  • AC-14338
  • NS00021751
  • GLYCINE BENZYL ESTER P-TOSYLATE
  • METHYL4-CHLORO-3,5-DINITROBENZOATE
  • M03020
  • benzyl 2-aminoacetate;4-methylbenzenesulonic acid
  • MFCD00035425
  • Benzyl glycinate p-toluenesulfonate
  • GLY-OBZL TOS
  • A851080
  • 4-methylbenzenesulfonate;(2-oxo-2-phenylmethoxyethyl)azanium
  • J-010948
  • H-Gly-OBzl.Tos-OH
  • glycine benzyl ester.p-toluenesulfonate
  • Z56904671
  • L-GLYCINE BENZYL ESTER P-TOLUENESULFONATE SALT
  • 80299-93-0
  • Glycine, phenylmethyl ester, 4-methylbenzenesulfonate (1:1)
  • AKOS001047309
  • Aminoacetic acid benzyl ester toluene-4-sulfonic acid salt
  • AS-12127
  • Glycine Benzyl Ester p-Toluenesulfonate
  • EN300-17277
  • glycine benzyl ester p-toluenesulphonate

MDL Number

MFCD00035425

Customs Code

2922499990

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