N-Methyl-L-phenylalanine tert-butyl ester
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Basic information
- CAS
114525-94-9- Standard SMILES
CN[C@@H](Cc1ccccc1)C(=O)OC(C)(C)C- InChIKey
UZKARLOPBFXQHH-LBPRGKRZSA-N- Molecular formula
- C14H21NO2
- Average molar mass
- 235.32 g/mol
Names & identifiers
- Preferred name
- N-Methyl-L-phenylalanine tert-butyl ester
- IUPAC
- tert-butyl (2S)-2-(methylamino)-3-phenylpropanoate
- English name
- N-Methyl-L-phenylalanine tert-butyl ester
- Molecular formula
- C14H21NO2
- Molecular weight
- 235.32
Names & synonyms
N-Me-Phe-otbu114525-94-9N-Methyl-L-phenylalanine tert-butyl estertert-butyl (2S)-2-(methylamino)-3-phenylpropanoateMFCD29077425SCHEMBL19945248Tert-butyl methyl-L-phenylalaninateG80711EN300-6747740tert-butyl (2S)-2-(methylamino)-3-phenyl-propanoateMePhe-tBuL-Phenylalanine, N-methyl-, 1,1-dimethylethyl ester
Database identifiers
- CAS
114525-94-9- Nikkaji
- J1.099.680E
Properties
Computed structural propertiesFilling in
- XLogP
- 2.1
- Topological polar surface area
- 38.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 6
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 239
Physicochemical properties
- storage temp.
- Store at Room Tem.
- Appearance
- Yellow Liquid
- 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
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
- 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
Chemistry & industry
Upstream & downstream products
Upstream raw materials
Related reactions
0 records
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Compound notes
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