Chemical Properties of L-Histidine, N-(trifluoroacetyl)-, butyl ester (CAS 55255-83-9)

L-Histidine, N-(trifluoroacetyl)-, butyl ester

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InChI
InChI=1S/C12H16F3N3O3/c1-2-3-4-21-10(19)9(5-8-6-16-7-17-8)18-11(20)12(13,14)15/h6-7,9H,2-5H2,1H3,(H,16,17)(H,18,20)/t9-/m0/s1
InChI Key
CCHOJMDTLLJCED-VIFPVBQESA-N
Formula
C12H16F3N3O3
SMILES
CCCCOC(=O)C(Cc1cnc[nH]1)NC(=O)C(F)(F)F
Molecular Weight1
307.27
CAS
55255-83-9
Other Names
  • His, butyl ester, N-TFA
  • His, butyl ester, TFA
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Physical Properties

Property Value Unit Source
log10WS -2.79 Crippen Calculated Property
logPoct/wat 0.861 Crippen Calculated Property
McVol 204.740 ml/mol McGowan Calculated Property
Inp [1983.00; 1983.00]   Show Hide
Inp 1983.00 NIST
Inp 1983.00 NIST

Similar Compounds

L-Histidine, 1-methyl-N-(trifluoroacetyl)-, butyl ester. Valine-glutamine-tryptophan-leucine, N(«alpha»,«epsilon»)-trifluoroacetyl-N-O-permethyl derivative. 5-Pregnen-3-«beta»-ol, 20-«alpha»-GlcNAc, MeTMS. Retroisosenine. 5-Pregnen-3-«alpha»,20-«alpha»-diol-20-GlcNAc TMS. Leu-Trp, N-trimethylsilyl-, trimethylsilyl ester. Poligodial + 3-methoxy-4,5-methylenedioxyamphetamine (R,S) adduct, # 1. Retroisosensine. Poligodial + 3-methoxy-4,5-methylenedioxyamphetamine (R,S) adduct, # 2. 7-diacetyllycopsamine. 3'-acetylmyoscorpine. 3'-acetylechiupinine. Grahamine. Nalmefene, trimethylsilyl ether. TCN.

Find more compounds similar to L-Histidine, N-(trifluoroacetyl)-, butyl ester.

Sources

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