N-Boc-5-hydroxyindole

C₁₃H₁₅NO₃CAS 434958-85-7233.27 g/mol

Open in Covalent MOL file

Properties

Molecular formula: C₁₃H₁₅NO₃
Molar mass: 233.27 g/mol
Exact mass: 233.1052 Da
logP: 3.13Crippen estimate
Polar surface area: 51.5 Å²
H-bond donors / acceptors: 1 / 3
Rotatable bonds: 0

Identifiers

CAS number

434958-85-7

SMILES

CC(C)(C)OC(=O)N1C=CC2=C1C=CC(=C2)O

InChIKey

BYFYKCHJFIWCPC-UHFFFAOYSA-N

InChI

InChI=1S/C13H15NO3/c1-13(2,3)17-12(16)14-7-6-9-8-10(15)4-5-11(9)14/h4-8,15H,1-3H3

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

Names and synonyms

1 names

1-Boc-5-hydroxyindole

Work with N-Boc-5-hydroxyindole

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

1,1-Dimethylethyl 5-amino-1H-indole-1-carboxylate166104-20-768 % similar 1-Boc-6-aminoindole219508-62-057 % similar N-Boc-2-pyrroleboronic acid135884-31-045 % similar 1-(tert-Butoxycarbonyl)indole-2-boronic Acid (contains varying amounts of Anhydride)213318-44-643 % similar (5-Bromo-1-(tert-butoxycarbonyl)-1H-indol-2-yl)boronic acid475102-13-743 % similar 1,1-Dimethylethyl 4-hydroxybenzoate25804-49-342 % similar 1,1-Dimethylethyl 5-amino-1H-indazole-1-carboxylate129488-10-441 % similar 1-(1,1-Dimethylethyl) 2-borono-5-cyano-1H-indole-1-carboxylate475102-15-941 % similar

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

Same formula

(4S)-(+)-4-Benzyl-3-propionyl-2-oxazolidinone101711-78-8 (R)-(-)-4-Benzyl-3-propionyl-2-oxazolidinone131685-53-5 Mecarbinate15574-49-9 3-(Cyclopentyloxy)-4-methoxyphenyl isocyanate185300-51-0 Benzyl 4-oxo-1-piperidinecarboxylate19099-93-5 3-Formyl-pyrrolidine-1-carboxylicacidbenzylester276872-86-7 Methyl 1-benzyl-5-oxo-3-pyrrolidinecarboxylate51535-00-3 1-Benzoyl-4-piperidinecarboxylic acid5274-99-7

Elsewhere

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