(3S)-3-{[(Benzyloxy)carbonyl]amino}-4-methoxy-4-oxobutanoic acid | CAS No. 4668-42-2

(3S)-3-{[(Benzyloxy)carbonyl]amino}-4-methoxy-4-oxobutanoic acid

Basic Information

CAS Number

4668-42-2

Molecular Formula

C13H15NO6

Molecular Weight

281.26 g/mol

AD

Basic Physical Properties

Melting Point

89.0 to 93.0 deg-C

Boiling Point

498.9±45.0 °C at 760 mmHg

Density

1.3±0.1 g/cm3

Flash Point

255.6±28.7 °C

Refractive Index

1.539

Vapor Pressure

0.0±1.3 mmHg at 25°C

COC(=O)C(CC(=O)O)NC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C13H15NO6/c1-19-12(17)10(7-11(15)16)14-13(18)20-8-9-5-3-2-4-6-9/h2-6,10H,7-8H2,1H3,(H,14,18)(H,15,16)/t10-/m0/s1

InChIKey

MFFFBNAPQRDRQW-JTQLQIEISA-N

LogP

0.9291

Topological Polar Surface Area

101.93000000000002 Ų

Hydrogen Bond Donor/Acceptor

2 / 7

Complexity

351

Safety Information

View Safety Information

GHS Hazard Pictograms

H302H302
H318H318
H332H332

Hazard Statement

H302 Harmful if swallowed
Acute toxicity, oral
H318 Causes serious eye damage
Serious eye damage/eye irritation
H332 Harmful if inhaled
Acute toxicity, inhalation

Synonyms & References

English

  • (S)-3-(((Benzyloxy)carbonyl)amino)-4-methoxy-4-oxobutanoic acid
  • DTXSID80427397
  • MFFFBNAPQRDRQW-JTQLQIEISA-N
  • 1-Methyl N-Carbobenzoxy-L-aspartate
  • DS-13996
  • 4668-42-2
  • AM81615
  • N-Carbobenzoxy-L-aspartic Acid 1-Methyl Ester
  • SCHEMBL1067460
  • N-CBZ L-aspartic acid 1-methyl ester
  • (S)-2-benzyloxycarbonylamino-succinic acid 1-methyl ester
  • J-300063
  • Z-Asp-OMe
  • MFCD00083277
  • M03042
  • M2707
  • (3S)-3-{[(BENZYLOXY)CARBONYL]AMINO}-4-METHOXY-4-OXOBUTANOIC ACID
  • 1-Methyl N-benzyloxycarbonyl-L-aspartate
  • Z-L-aspartic acid
  • 1-Methyl N-Cbz-L-aspartate
  • (3S)-3-(((benzyloxy)carbonyl)amino)-4-methoxy-4-oxobutanoic acid
  • (3S)-4-methoxy-4-oxo-3-(phenylmethoxycarbonylamino)butanoic acid
  • N-Cbz-L-Aspartic acid 1-methyl ester
  • Z-L-Asp-OMe
  • HY-W009328
  • CS-W010044
  • AC9386
  • A-methyl ester
  • Q-101789
  • N-Benzyloxycarbonyl-L-aspartic acid 1-methyl ester
  • L-Aspartic acid, N-[(phenylmethoxy)carbonyl]-, 1-methyl ester

MDL Number

MFCD00083277

Customs Code

29224999

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