(S)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)(methyl)amino)-3-phenylpropanoic acid
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Basic information
- CAS
77128-73-5- Standard SMILES
CN(C(=O)OCC1c2ccccc2-c2ccccc21)[C@@H](Cc1ccccc1)C(=O)O- InChIKey
GBROUWPNYVBLFO-QHCPKHFHSA-N- Molecular formula
- C25H23NO4
- Average molar mass
- 401.5 g/mol
- Monoisotopic mass
- 401.16270821
Names & identifiers
- Preferred name
- (S)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)(methyl)amino)-3-phenylpropanoic acid
- IUPAC
- (2S)-2-[9H-fluoren-9-ylmethoxycarbonyl(methyl)amino]-3-phenylpropanoic acid
- English name
- Fmoc-N-methyl-L-phenylalanine
- Molecular formula
- C25H23NO4
- Molecular weight
- 401.45
Names & synonyms
77128-73-5(S)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)(methyl)amino)-3-phenylpropanoic acid(S)-2-[[[(9H-Fluoren-9-yl)methoxy]carbonyl](methyl)amino]-3-phenylpropanoic acidRefChem:407833844-850-8Fmoc-N-Me-Phe-OHFmoc-N-methyl-L-phenylalanineFmoc-MePhe-OHMFCD00151938N-Fmoc-N-methyl-L-phenylalanineFmoc-Nalpha-methyl-L-phenylalanine(2S)-2-[9H-fluoren-9-ylmethoxycarbonyl(methyl)amino]-3-phenylpropanoic acid
Show more names
FMOC-L-MEPHE-OHFMOC-N-ME-PHE 98.5+%FMOC-N-ME-PHENYLALANINEFmoc-N-mety)-L-phenylalanine
N-[(9H-Fluoren-9-ylmethoxy)carbonyl]-N-methyl-L-phenylalanineAKOS015837150CS-W011702AC-24162N-(((9H-Fluoren-9-yl)methoxy)carbonyl)-N-methyl-L-phenylalanineFmoc-N-Me-L-Phe-OHL-Phenylalanine, N-[(9H-fluoren-9-ylmethoxy)carbonyl]-N-methyl-A850900
Database identifiers
- CAS
Properties
Computed structural propertiesFilling in
- XLogP
- 4.8
- Topological polar surface area
- 66.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 580
Physicochemical properties
- Melting point
- 132 to · 132.0 to 136.0 °C
- Boiling point
- 595.4 · 595.4±39.0 °C(Predicted)
- Density
- 1.26 · 1.260±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C
- solubility
- Soluble in DMF. (0.3gram in 2ml)
- pka
- 3.78 · 3.78±0.10(Predicted)
- form
- Powder
- color
- Off-white
- optical activity
- 20 · [α]20/D 55.0±3°, c = 1% in DMF
- BRN
- 4768138 · 4768138
- Major Application
- peptide synthesis
- InChI
- InChI=1S/C25H23NO4/c1-26(23(24(27)28)15-17-9-3-2-4-10-17)25(29)30-16-22-20-13-7-5-11-18(20)19-12-6-8-14-21(19)22/h2-14,22-23H,15-16H2,1H3,(H,27,28)/t23-/m0/s1
- InChIKey
- GBROUWPNYVBLFO-QHCPKHFHSA-N
- SMILES
- C(O)(=O)[C@H](CC1=CC=CC=C1)N(C(OCC1C2=C(C=CC=C2)C2=C1C=CC=C2)=O)C
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesSkin Irrit. 2 (100%)
Safety data
- PPE
- Eyeshields, Gloves, type N95 (US)
- wgk
- 3
- hs_code
- 2924 29 70
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- safety_code
- 22-24/25
- hazard_class
- IRRITANT
- Storage Class
- 13 - Non Combustible Solids
- Hazard statements
- H302-H312-H332
- Precautionary statements
- P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P330-P362-P403+P233-P501
Chemistry & industry
Applications
UsesN-Fmoc-N-methyl-L-phenylalanine is used in agrochemical, pharmaceutical and dyestuff field.
Upstream & downstream products
Upstream raw materials
Related reactions
4 records
Compound notes
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