Serine, 2-(fluoromethyl)-, methyl ester
Basic information
- CAS
151028-30-7- Standard SMILES
COC(=O)[C@@](N)(CO)CF- InChIKey
VJCMZUHVPZMXJS-YFKPBYRVSA-N- Molecular formula
- C5H10FNO3
- Average molar mass
- 151.14 g/mol
Names & identifiers
- Preferred name
- Serine, 2-(fluoromethyl)-, methyl ester
- IUPAC
- methyl (2S)-2-amino-2-(fluoromethyl)-3-hydroxypropanoate
- English name
- Serine, 2-(fluoromethyl)-, methyl ester (9CI)
- Molecular formula
- C5H10FNO3
- Molecular weight
- 151.14
Names & synonyms
Serine, 2-(fluoromethyl)-, methyl ester151028-30-7Serine, 2-(fluoromethyl)-, methyl ester (9CI)
Database identifiers
- CAS
151028-30-7
Properties
Computed structural properties
- XLogP
- -1.3
- Topological polar surface area
- 72.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 130
Physicochemical properties
- Boiling point
- 267.1 · 267.1±35.0 °C(Predicted)
- Density
- 1.246 · 1.246±0.06 g/cm3(Predicted)
- pka
- 11.43 · 11.43±0.20(Predicted)
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Compound notes
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