Fmoc-oic-oh

C₂₄H₂₅NO₄CAS 130309-37-4391.47 g/mol

Open in Covalent MOL file

Carbamate Carboxylic acid

Properties

Molecular formula: C₂₄H₂₅NO₄
Molar mass: 391.47 g/mol
Exact mass: 391.1784 Da
logP: 4.65Crippen estimate
Polar surface area: 66.8 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 3
Stereocentres: S, S, Sin SMILES atom order

Identifiers

CAS number

130309-37-4

SMILES

C1CC[C@H]2[C@@H](C1)C[C@H](N2C(=O)OCC3C4=CC=CC=C4C5=CC=CC=C35)C(=O)O

InChIKey

JBZXLQHJZHITMW-RXYZOABWSA-N

InChI

InChI=1S/C24H25NO4/c26-23(27)22-13-15-7-1-6-12-21(15)25(22)24(28)29-14-20-18-10-4-2-8-16(18)17-9-3-5-11-19(17)20/h2-5,8-11,15,20-22H,1,6-7,12-14H2,(H,26,27)/t15-,21-,22-/m0/s1

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

Names and synonyms

1 names

(2S,3aS,7aS)-1-(((9H-fluoren-9-yl)methoxy)carbonyl)-octahydro-1H-indole-2-carboxylic acid

Work with Fmoc-oic-oh

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

D-Fmoc-pipecolic acid101555-63-965 % similar 1-[(9H-Fluoren-9-ylmethoxy)carbonyl]piperidine-2-carboxylic acid105751-19-765 % similar N-(9-Fluorenylmethoxycarbonyl)-D-proline101555-62-864 % similar Fmoc-pro-oh71989-31-664 % similar Fmoc-N-methyl-L-norleucine112883-42-859 % similar (4S)-1-Fmoc-4-methyl-L-proline1228577-03-459 % similar N-[(9H-Fluoren-9-ylmethoxy)carbonyl]-N-methyl-L-norvaline252049-05-159 % similar N-Alpha-(9-Fluorenylmethyloxycarbonyl)-L-prolinyl-L-proline129223-22-958 % similar

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

Same formula

Flavoxate15301-69-6

Elsewhere

PubChem CAS Common Chemistry NIST WebBook