(R)-2-Amino-3-(4-((2,6-dichlorobenzyl)oxy)phenyl)propanoic acid
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Basic information
- CAS
877932-39-3- Standard SMILES
N[C@H](Cc1ccc(OCc2c(Cl)cccc2Cl)cc1)C(=O)O- InChIKey
FTZFICPDLOOUKO-OAHLLOKOSA-N- Molecular formula
- C16H15Cl2NO3
- Average molar mass
- 340.2 g/mol
- Monoisotopic mass
- 339.0428987
Names & identifiers
- Preferred name
- (R)-2-Amino-3-(4-((2,6-dichlorobenzyl)oxy)phenyl)propanoic acid
- IUPAC
- (2R)-2-amino-3-[4-[(2,6-dichlorophenyl)methoxy]phenyl]propanoic acid
- English name
- D-Tyrosine, O-[(2,6-dichlorophenyl)methyl]-
- Molecular formula
- C16H15Cl2NO3
- Molecular weight
- 340.2
Names & synonyms
877932-39-3(R)-2-Amino-3-(4-((2,6-dichlorobenzyl)oxy)phenyl)propanoic acidMFCD03788051(2R)-2-AMINO-3-(4-[(2,6-DICHLOROPHENYL)METHOXY]PHENYL)PROPANOIC ACID(2R)-2-amino-3-[4-[(2,6-dichlorophenyl)methoxy]phenyl]propanoic acidO-2,6-Dichlorobenzyl-D-tyrosine(2R)-2-AMINO-3-{4-[(2,6-DICHLOROPHENYL)METHOXY]PHENYL}PROPANOIC ACIDSCHEMBL14037387G84391(R)-2-Amino-3-(4-((2,6-dichlorobenzyl)oxy)phenyl)propanoicacidD-Tyrosine, O-[(2,6-dichlorophenyl)methyl]-
Database identifiers
- CAS
877932-39-3- PubChem CID
- 56777094
Properties
Computed structural propertiesFilling in
- XLogP
- 1.6
- Topological polar surface area
- 72.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 6
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 351
Physicochemical properties
- Boiling point
- 503.8 · 503.8±50.0 °C(Predicted)
- Density
- 1.382 · 1.382±0.06 g/cm3(Predicted)
- pka
- 2.23 · 2.23±0.10(Predicted)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 302 · H302-H315-H319-H335
- Precautionary statements
- 280 · P280-P305+P351+P338
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
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- Hazard statements
- H302-H315-H319-H335
- Precautionary statements
- P280-P305+P351+P338
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Compound notes
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