N-Carbethoxy-4-tropinone

C₁₀H₁₅NO₃CAS 32499-64-2197.23 g/mol

Open in Covalent MOL file

Carbamate Ketone

Properties

Molecular formula: C₁₀H₁₅NO₃
Molar mass: 197.23 g/mol
Exact mass: 197.1052 Da
logP: 1.34Crippen estimate
Polar surface area: 46.6 Å²
H-bond donors / acceptors: 0 / 3
Rotatable bonds: 1

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

32499-64-2

SMILES

CCOC(=O)N1C2CCC1CC(=O)C2

InChIKey

ANEJUHJDPGTVIO-UHFFFAOYSA-N

InChI

InChI=1S/C10H15NO3/c1-2-14-10(13)11-7-3-4-8(11)6-9(12)5-7/h7-8H,2-6H2,1H3

Weigh it out

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

Names and synonyms

1 names

Ethyl 3-oxo-8-azabicyclo(3.2.1)octane-8-carboxylate

Work with N-Carbethoxy-4-tropinone

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

N-Boc-nortropinone185099-67-658 % similar N-Cbz-nortropinone130753-13-855 % similar N-Boc-9-azabicyclo[3.3.1]nonan-3-one512822-27-451 % similar N-Boc-cis-2,6-diethyl-4-piperidone1003843-30-848 % similar 1-(Ethoxycarbonyl)-4-piperidone29976-53-247 % similar Ethyl 3-oxo cyclobuatne carboxylate87121-89-946 % similar Tropinone532-24-145 % similar 1-N-Ethoxycarbonyl-3-pyrrolidone14891-10-245 % similar

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

Same formula

3,4,5-Trimethoxybenzylamine18638-99-8 Vinyl acetate-vinylpyrrolidone copolymer25086-89-9 Desglymidodrine3600-87-1 2-Carbomethoxytropinone36127-17-0

Elsewhere

PubChem CAS Common Chemistry NIST WebBook