(2S)-1-(Benzyloxy)-1-oxo-3-phenyl-2-propanaminium 4-methylbenzenesulfonate | CAS No. 1738-78-9

(2S)-1-(Benzyloxy)-1-oxo-3-phenyl-2-propanaminium 4-methylbenzenesulfonate

Basic Information

CAS Number

1738-78-9

Molecular Formula

C23H25NO5S

Molecular Weight

427.52 g/mol

AD

Basic Physical Properties

Melting Point

143-150°C

Boiling Point

382.8°Cat760mmHg

Density

1.142

Flash Point

220.3°C

CC1=CC=C(C=C1)S(=O)(=O)O.C1=CC=C(C=C1)CC(C(=O)OCC2=CC=CC=C2)N

InChI

InChI=1S/C16H17NO2.C7H8O3S/c17-15(11-13-7-3-1-4-8-13)16(18)19-12-14-9-5-2-6-10-14;1-6-2-4-7(5-3-6)11(8,9)10/h1-10,15H,11-12,17H2;2-5H,1H3,(H,8,9,10)/t15-;/m0./s1

InChIKey

ZLZGBBIPWXUQST-RSAXXLAASA-N

LogP

3.541520000000002

Topological Polar Surface Area

106.69 Ų

Hydrogen Bond Donor/Acceptor

3 / 6

Complexity

474

Safety Information

View Safety Information

Hazard Statement

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

  • H-PHE-OBZL P-TOSYLATE
  • O-Benzyl-3-phenyl-L-alanine toluene-4-sulphonate
  • benzyl (2S)-2-amino-3-phenylpropanoate;4-methylbenzenesulfonic acid
  • L-phenylalanine benzyl ester p-toluenesulfonic acid salt
  • H-Phe-OBzl. Tos
  • AKOS015842537
  • NS00081919
  • H-L-Phe-OBzl*Tos
  • L-Phenylalanine benZyl ester tosylate (H-L-Phe-OBZl.Tos)
  • L-phenylalanine benzyl ester p-toluenesulfonate
  • H-Phe-OBzl Tos
  • L-Phenylalanine benzyl ester tosylate
  • AKOS015889729
  • AM82164
  • H-Phe-OBzl.TosOH
  • 3-phenyl-l-alanine benzyl ester 4-toluenesulphonate
  • F10697
  • 4-methylbenzene-1-sulfonic acid; benzyl (2S)-2-amino-3-phenylpropanoate
  • HY-W008962
  • Q-101833
  • H-Phe-Obzl.TOS
  • (S)-Benzyl 2-amino-3-phenylpropanoate 4-methylbenzenesulfonate
  • MFCD00066130
  • L-Phe-OBzl⋅TosOH
  • NSC 524126
  • L-Phenylalanine, phenylmethyl ester, 4-methylbenzenesulfonate (1:1)
  • Benzyl L-phenylalaninate p-toluenesulfonate
  • L-Phenylalanine benzyl ester 4-toluenesulfonate salt
  • 4-Methylbenzenesulfonate;[(2S)-1-oxo-3-phenyl-1-phenylmethoxypropan-2-yl]azanium
  • ZLZGBBIPWXUQST-RSAXXLAASA-N
  • 1738-78-9

MDL Number

MFCD00066130

Customs Code

2922499990

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