Fmoc-val-opfp

C26H20F5NO4CAS 86060-87-9505.44 g/mol

Open in Covalent MOL file
OOFFFFFNHOO
Aryl halideCarbamateEster

Properties

Molecular formula
C26H20F5NO4
Molar mass
505.44 g/mol
Exact mass
505.1312 Da
logP
5.85Crippen estimate
Polar surface area
64.6 Ų
H-bond donors / acceptors
1 / 4
Rotatable bonds
6
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
86060-87-9
SMILES
CC(C)[C@@H](C(=O)OC1=C(C(=C(C(=C1F)F)F)F)F)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24
InChIKey
TZEGAVSWQUEHAQ-QHCPKHFHSA-N
InChI
InChI=1S/C26H20F5NO4/c1-12(2)23(25(33)36-24-21(30)19(28)18(27)20(29)22(24)31)32-26(34)35-11-17-15-9-5-3-7-13(15)14-8-4-6-10-16(14)17/h3-10,12,17,23H,11H2,1-2H3,(H,32,34)/t23-/m0/s1

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Tanimoto similarity of circular fingerprints over the whole catalogue.

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