(S)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3-(2-(trifluoromethyl)phenyl)propanoic acid
Properties
- Molecular formula
- C25H20F3NO4
- Molar mass
- 455.43 g/mol
- Exact mass
- 455.1344 Da
- logP
- 5.24Crippen estimate
- Polar surface area
- 75.6 Ų
- H-bond donors / acceptors
- 2 / 3
- Rotatable bonds
- 6
- Stereocentres
- Sin SMILES atom order
Identifiers
CAS number
352523-16-1SMILES
C1=CC=C(C(=C1)C[C@@H](C(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24)C(F)(F)FInChIKey
KSQOLKMHJFBQNA-QFIPXVFZSA-NInChI
InChI=1S/C25H20F3NO4/c26-25(27,28)21-12-6-1-7-15(21)13-22(23(30)31)29-24(32)33-14-20-18-10-4-2-8-16(18)17-9-3-5-11-19(17)20/h1-12,20,22H,13-14H2,(H,29,32)(H,30,31)/t22-/m0/s1Weigh it out
Type any one amount. The others follow from the molar mass.
Names and synonyms
1 names
- Fmoc-L-2-trifluoromethylphenylalanine
Work with (S)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3-(2-(trifluoromethyl)phenyl)propanoic acid
Stereoisomers, salts and isotopologues
The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.
Similar compounds
Fmoc-L-2-chlorophe198560-41-771 % similar
Fmoc-2-chloro-D-phenylalanine205526-22-371 % similar
Fmoc-L-2-bromophenylalanine220497-47-271 % similar
Fmoc-D-2-bromophenylalanine220497-79-071 % similar
Fmoc-L-2-methylphe211637-75-170 % similar
Fmoc-(R)-3-amino-4-(2-trifluoromethyl-phenyl)-butyric acid269726-72-970 % similar
Boc-L-2-trifluoromethylphe167993-21-768 % similar
Fmoc-phe-oh286460-71-767 % similar
Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds