Fmoc-L-alaninol

C₁₈H₁₉NO₃CAS 161529-13-1297.35 g/mol

Open in Covalent MOL file

Alcohol Carbamate

Properties

Molecular formula: C₁₈H₁₉NO₃
Molar mass: 297.35 g/mol
Exact mass: 297.1365 Da
logP: 2.91Crippen estimate
Polar surface area: 58.6 Å²
H-bond donors / acceptors: 2 / 3
Rotatable bonds: 4
Stereocentres: Sin SMILES atom order

Identifiers

CAS number

161529-13-1

SMILES

C[C@@H](CO)NC(=O)OCC1C2=CC=CC=C2C3=CC=CC=C13

InChIKey

GIZCEJUGNDJXMH-LBPRGKRZSA-N

InChI

InChI=1S/C18H19NO3/c1-12(10-20)19-18(21)22-11-17-15-8-4-2-6-13(15)14-7-3-5-9-16(14)17/h2-9,12,17,20H,10-11H2,1H3,(H,19,21)/t12-/m0/s1

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Work with Fmoc-L-alaninol

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

Fmoc-L-beta-homoalanine193954-26-672 % similar Fmoc-L-leucinol139551-83-070 % similar N-Fmoc-L-threonol176380-53-370 % similar Fmoc-D-threoninol252049-02-870 % similar Fmoc-thr(tbu)-ol189337-28-867 % similar Fmoc-D-ser-oh116861-26-866 % similar Fmoc-phenylalaninol129397-83-766 % similar Nalpha-fmoc-L-serine tert-butyl ester110797-35-865 % similar

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

Same formula

N-(9-Fluorenylmethoxycarbonyl)-3-aminopropan-1-ol157887-82-6 (±)-Aegeline456-12-2 Erythraline466-77-3

Elsewhere

PubChem CAS Common Chemistry NIST WebBook