(S)-Morpholine-3-carboxylic acid

C₅H₉NO₃CAS 106825-79-0131.13 g/mol

Open in Covalent MOL file

Carboxylic acid Ether Secondary amine

Properties

Molecular formula: C₅H₉NO₃
Molar mass: 131.13 g/mol
Exact mass: 131.0582 Da
logP: -0.94Crippen estimate
Polar surface area: 58.6 Å²
H-bond donors / acceptors: 2 / 3
Rotatable bonds: 1
Stereocentres: Sin SMILES atom order

Identifiers

CAS number

106825-79-0

SMILES

C1COC[C@H](N1)C(=O)O

InChIKey

JUNOWSHJELIDQP-BYPYZUCNSA-N

InChI

InChI=1S/C5H9NO3/c7-5(8)4-3-9-2-1-6-4/h4,6H,1-3H2,(H,7,8)/t4-/m0/s1

Weigh it out

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

Names and synonyms

1 names

(S)-3-Morpholinecarboxylic acid hcl

Work with (S)-Morpholine-3-carboxylic acid

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

Azetidine-2-carboxylic acid2133-34-855 % similar (±)-2-Azetidinecarboxylic acid2517-04-655 % similar Proline147-85-352 % similar D-Proline344-25-252 % similar Dl-proline609-36-952 % similar (S)-Piperazine-2-carboxylic acid147650-70-250 % similar (+)-Pipecolic acid1723-00-850 % similar Pipecolic acid3105-95-150 % similar

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

Same formula

5-Aminolevulinic acid106-60-5 N-Acetylalanine1115-69-1 3-Aminotetrahydrofuran-3-carboxylic acid125218-55-5 N-Acetyl-D-alanine19436-52-3 cis-4-Hydroxy-D-proline2584-71-6 Acetyl-β-alanine3025-95-4 Ethyl N-formylglycinate3154-51-6 trans-3-Hydroxy-L-proline4298-08-2

Elsewhere

PubChem CAS Common Chemistry NIST WebBook