Boc-trp-ome

C17H22N2O4CAS 33900-28-6318.37 g/mol

Open in Covalent MOL file
OONHNHOO
CarbamateEster

Properties

Molecular formula
C17H22N2O4
Molar mass
318.37 g/mol
Exact mass
318.1580 Da
logP
2.78Crippen estimate
Polar surface area
80.4 Ų
H-bond donors / acceptors
2 / 4
Rotatable bonds
4
Stereocentres
Sin SMILES atom order

Hazards

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

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Identifiers

CAS number
33900-28-6
SMILES
CC(C)(C)OC(=O)N[C@@H](CC1=CNC2=CC=CC=C21)C(=O)OC
InChIKey
QXLOVPXUZAOKBL-AWEZNQCLSA-N
InChI
InChI=1S/C17H22N2O4/c1-17(2,3)23-16(21)19-14(15(20)22-4)9-11-10-18-13-8-6-5-7-12(11)13/h5-8,10,14,18H,9H2,1-4H3,(H,19,21)/t14-/m0/s1

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Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Same formula

1-(2-Phenylacetyl)-L-prolylglycine ethy ester157115-85-0 Boc-L-beta-homotryptophan229639-48-9 Imiprothrin72963-72-5

Elsewhere

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