5-Fluorotryptophan, D-
Basic information
- CAS
97749-24-1- Standard SMILES
N[C@H](Cc1c[nH]c2ccc(F)cc12)C(=O)O- InChIKey
INPQIVHQSQUEAJ-SECBINFHSA-N- Molecular formula
- C11H11FN2O2
- Average molar mass
- 222.22 g/mol
- Monoisotopic mass
- 222.08045576
Names & identifiers
- Preferred name
- 5-Fluorotryptophan, D-
- IUPAC
- (2R)-2-amino-3-(5-fluoro-1H-indol-3-yl)propanoic acid
- English name
- (R)-2-Amino-3-(5-fluoro-1H-indol-3-yl)-propionic acid
- Molecular formula
- C11H11FN2O2
- Molecular weight
- 222.22
Names & synonyms
5-fluoro-d-tryptophanD-5-fluorotryptophanD-Tryptophan, 5-fluoro-5-Fluorotryptophan, D-7X85O74VU5UNII-7X85O74VU5DTXSID10350886RefChem:198912DTXCID5030195397749-24-1(R)-2-amino-3-(5-fluoro-1H-indol-3-yl)propanoic acid(2R)-2-amino-3-(5-fluoro-1H-indol-3-yl)propanoic acid
Show more names
D-Trp(5-F)-OH(R)-α-Amino-5-fluoro-1H-indole-3-propionic acid
MFCD06797666H-D-Trp(5-F)-OHSCHEMBL249955(R)-alpha-Amino-5-fluoro-1H-indole-3-propionic acidSCHEMBL29623154(R)-2-AMINO-3-(5-FLUORO-1H-INDOL-3-YL)-PROPIONIC ACIDAKOS015911051FF52377
Database identifiers
- CAS
97749-24-1- PubChem CID
- 688358
- DTXSID
DTXSID10350886- UNII
- 7X85O74VU5
- Nikkaji
- J232.143B
Properties
Computed structural properties
- XLogP
- -0.7
- Topological polar surface area
- 79.1 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 275
Physicochemical properties
- Boiling point
- 450.71 · 450.710±45.00 °C(Press: 760.00 Torr)(predicted)
- Density
- 1.442 · 1.442±0.06 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
- storage temp.
- Store at Room Tem.
- pka
- 2.209 · 2.209±0.10(predicted)
- Appearance
- off-white to brown powder
- FDA UNII
- 7 X85O74VU5 · 7X85O74VU5
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 315 · H315-H319-H335
- Precautionary statements
- 264 · P264-P280-P302+P352-P321-P332+P313-P362-P305+P351+P338-P337+P313-P261-P271-P304+P340-P312-P403+P233-P405-P501
- HS Code
- 2933998090 · 2933998090
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- hs_code
- 2933998090
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H315-H319-H335
- Precautionary statements
- P264-P280-P302+P352-P321-P332+P313-P362-P305+P351+P338-P337+P313-P261-P271-P304+P340-P312-P403+P233-P405-P501
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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