Z-Dl-asparagine

C12H14N2O5CAS 29880-22-6266.25 g/mol

Open in Covalent MOL file
OOHNONH2OHO
AmideCarbamateCarboxylic acid

Properties

Molecular formula
C12H14N2O5
Molar mass
266.25 g/mol
Exact mass
266.0903 Da
logP
0.24Crippen estimate
Polar surface area
118.7 Ų
H-bond donors / acceptors
3 / 4
Rotatable bonds
6

Hazards

Warning
Irritant (GHS07)

Aggregated from the ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, P501

Identifiers

CAS number
29880-22-6
SMILES
C1=CC=C(C=C1)COC(=O)NC(CC(=O)N)C(=O)O
InChIKey
FUCKRCGERFLLHP-UHFFFAOYSA-N
InChI
InChI=1S/C12H14N2O5/c13-10(15)6-9(11(16)17)14-12(18)19-7-8-4-2-1-3-5-8/h1-5,9H,6-7H2,(H2,13,15)(H,14,18)(H,16,17)

Weigh it out

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

Names and synonyms

1 names
  • Carbobenzoxy-L-asparagine

Work with Z-Dl-asparagine

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

Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

N2-[(Phenylmethoxy)carbonyl]-L-asparagine2304-96-3Defined stereoisomer

Similar compounds

Z-D-Gln-oh13139-52-178 % similar N-Carbobenzoxy-dl-aspartic acid4515-21-376 % similar (2R)-2-(((Benzyloxy)carbonyl)amino)butanedioic acid78663-07-776 % similar N-Cbz-D-serine6081-61-471 % similar (2S)-2-(((Benzyloxy)carbonyl)amino)-4-methoxy-4-oxobutanoic acid3160-47-269 % similar Z-Asn(trt)-oh132388-57-968 % similar N-Alpha-Benzyloxycarbonyl-L-ornithine2640-58-667 % similar N-Cbz-D-leucine28862-79-567 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

Carbobenzoxyglycylglycine2566-19-0 N-(4-Aminobenzoyl)-L-glutamic acid4271-30-1

Elsewhere

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