O-Benzyltyrosine | CAS No. 16652-64-5

O-Benzyltyrosine

Basic Information

CAS Number

16652-64-5

Molecular Formula

C16H17NO3

Molecular Weight

271.32 g/mol

AD

Basic Physical Properties

Physical State

Powder

Melting Point

259 °C (dec.)

Boiling Point

456.1°C at 760 mmHg

Flash Point

229.7±27.3 °C

Refractive Index

-10 ° (C=1, 80% AcOH)

Vapor Pressure

0.0±1.2 mmHg at 25°C

Specific Rotation

-8.0 to -12.0° (c=1%, in acetic acid: H2O 4:1)

C1=CC=C(C=C1)COC2=CC=C(C=C2)CC(C(=O)O)N

InChI

InChI=1S/C16H17NO3/c17-15(16(18)19)10-12-6-8-14(9-7-12)20-11-13-4-2-1-3-5-13/h1-9,15H,10-11,17H2,(H,18,19)/t15-/m0/s1

InChIKey

KAFHLONDOVSENM-HNNXBMFYSA-N

LogP

2.22

Topological Polar Surface Area

72.55 Ų

Hydrogen Bond Donor/Acceptor

3 / 4

Complexity

294

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

Hazard Class

Class IRRITANT Class IRRITANT

Synonyms & References

English

  • AKOS015924196
  • AKOS012010906
  • CHEBI:183835
  • A13805
  • CHEMBL147608
  • NSC-163630
  • B3210
  • M03100
  • EN300-303158
  • (S)-2-Amino-3-(4benzyloxy-phenyl)-propionic acid
  • Tyrosine, O-(phenylmethyl)-
  • (S)-2-amino-3-(4-(benzyloxy)phenyl)propanoic acid
  • BDBM50000013
  • DTXSID701315699
  • H-Tyr(Bn)-OH
  • L-Tyrosine, O-(phenylmethyl)-
  • UNII-I2YT97EQE9
  • AM82344
  • O-Benzyl-L-tyrosine, >=99.0% (NT)
  • O-benzyltyrosine
  • (S)-2-amino-3-(4-benzyloxyphenyl)propionic acid
  • Q27466780
  • AS-17222
  • EINECS 240-699-1
  • W-107923
  • (2S)-2-amino-3-(4-phenylmethoxyphenyl)propanoic acid
  • CS-W010097
  • MFCD00002605
  • H-Tyr(Bzl)-Oh
  • NSC 163630
  • (S)-2-Amino-3-(4-benzyloxy-phenyl)-propionic acid

MDL Number

MFCD00002605

Customs Code

2922509090

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