Boc-L-2-trifluoromethylphe

C15H18F3NO4CAS 167993-21-7333.31 g/mol

OONHFFFOHO
Alkyl halideCarbamateCarboxylic acid

Properties

Molecular formula
C15H18F3NO4
Molar mass
333.31 g/mol
Exact mass
333.1188 Da
logP
3.23Crippen estimate
Polar surface area
75.6 Ų
H-bond donors / acceptors
2 / 3
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. Search the SDS library

Identifiers

CAS number
167993-21-7
SMILES
CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC=C1C(F)(F)F)C(=O)O
InChIKey
XKMOOODKNPYTEE-NSHDSACASA-N
InChI
InChI=1S/C15H18F3NO4/c1-14(2,3)23-13(22)19-11(12(20)21)8-9-6-4-5-7-10(9)15(16,17)18/h4-7,11H,8H2,1-3H3,(H,19,22)(H,20,21)/t11-/m0/s1

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Names and synonyms

1 names
  • Boc-2-(trifluoromethyl)-L-phenylalanine

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Similar compounds

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

Same formula

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