chempirical

N-Benzyloxycarbonyl-dl-serine

C11H13NO5CAS 2768-56-1239.23 g/mol

Open in Covalent MOL file
OHOHONHOO
AlcoholCarboxylic acid

Properties

Molecular formula
C11H13NO5
Molar mass
239.23 g/mol
Exact mass
239.0794 Da
Melting point
125 °C
logP
0.56Crippen estimate
Polar surface area
99.3 Ų
H-bond donors / acceptors
3 / 4
Rotatable bonds
5

Identifiers

CAS number
2768-56-1
SMILES
O=C(O)C(CO)N=C(O)OCc1ccccc1
InChIKey
GNIDSOFZAKMQAO-UHFFFAOYSA-N
InChI
InChI=1S/C11H13NO5/c13-6-9(10(14)15)12-11(16)17-7-8-4-2-1-3-5-8/h1-5,9,13H,6-7H2,(H,12,16)(H,14,15)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

11 names
  • 2-Benzyloxycarbonylamino-3-hydroxy-propionic acid
  • Serine, N-[(phenylmethoxy)carbonyl]-
  • Serine, N-carboxy-, N-benzyl ester, DL-
  • DL-Serine, N-carboxy-, N-benzyl ester
  • N-[(Phenylmethoxy)carbonyl]serine
  • N-Carbobenzoxy-DL-serine
  • N-Carbobenzyloxy-DL-serine
  • NSC 118530
  • NSC 22029
  • 3-Hydroxy-2-(phenylmethoxycarbonylamino)propanoic acid
  • 2-[[(Benzyloxy)carbonyl]amino]-3-hydroxypropanoic acid

Work with N-Benzyloxycarbonyl-dl-serine

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Benzyloxycarbonyl-L-phenylalanine1161-13-378 % similar N-(Benzyloxycarbonyl)-D-phenylalanine2448-45-578 % similar N-(Benzyloxycarbonyl)-dl-phenylalanine3588-57-678 % similar N-[(Phenylmethoxy)carbonyl]-O-(phenylmethyl)-L-serine20806-43-374 % similar (2S)-2-[[(Phenylmethoxy)carbonyl]amino]butanoic acid42918-86-574 % similar 3-Amino-N-[(phenylmethoxy)carbonyl]-D-alanine62234-37-174 % similar N,N′-Bis[(phenylmethoxy)carbonyl]-L-cystine6968-11-274 % similar Benzyloxycarbonyl-L-aspartic acid1152-61-073 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

N-(Benzyloxycarbonyl)-L-serine1145-80-8

Elsewhere

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