(S)-alpha-Fluoromethylhistidine 2 HCl

HCID 178479221
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Basic information

Standard SMILES
Cl.N[C@@](CF)(Cc1c[nH]cn1)C(=O)O
InChIKey
AJTAPCUFVRUIEO-OGFXRTJISA-N
Molecular formula
C7H11ClFN3O2
Average molar mass
223.63 g/mol
Monoisotopic mass
223.0523825

Names & identifiers

Preferred name
(S)-alpha-Fluoromethylhistidine 2 HCl
IUPAC
(2S)-2-amino-2-(fluoromethyl)-3-(1H-imidazol-5-yl)propanoic acid;hydrochloride

Names & synonyms

orb1701425SCHEMBL10723229AJTAPCUFVRUIEO-OGFXRTJISA-NAKOS040747621(S)-alpha-Fluoromethylhistidine 2 HCl(+/-) alpha-fluoromethylhistidine hydrochlorideT26374

Database identifiers

PubChem CID
45052489

Properties

Computed structural properties

Topological polar surface area
92 Ų
Hydrogen bond donors
4
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
14

Related reactions

1 records
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Compound notes

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