N-Fmoc-4-methanesulfonylamino-L-phenylalanine

Base Information

• Chemical Name: N-Fmoc-4-methanesulfonylamino-L-phenylalanine
• CAS No.: 266999-22-8
• Molecular Formula: C25H24 N2 O6 S
• Molecular Weight: 480.53
• Hs Code.: 2935009090
• DSSTox Substance ID: DTXSID70705277
• Wikidata: Q82638083
• Mol file: 266999-22-8.mol

Synonyms:266999-22-8;N-FMOC-4-METHANESULFONYLAMINO-L-PHENYLALANINE;(2S)-2-(9H-fluoren-9-ylmethoxycarbonylamino)-3-[4-(methanesulfonamido)phenyl]propanoic acid;(S)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3-(4-(methylsulfonamido)phenyl)propanoic acid;fmoc-4-((methylsulfonyl)amino)-l-phenylalanine;Fmoc-4-[(Methylsulfonyl)amino]-L-phenylalanine;L-Phenylalanine,N-[(9H-fluoren-9-ylmethoxy)carbonyl]-4-[(methylsulfonyl)amino]-;(S)-2-(9H-FLUOREN-9-YLMETHOXYCARBONYLAMINO)-3-(4-METHANESULFONYLAMINO-PHENYL)-PROPIONIC ACID;SCHEMBL16095139;DTXSID70705277;MFCD01860660;AS-37753;CS-0172668;A911055;N-{[(9H-Fluoren-9-yl)methoxy]carbonyl}-4-[(methanesulfonyl)amino]-L-phenylalanine;(S)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3-(4-(methylsulfonamido)phenyl)propanoicacid

Chemical Property of N-Fmoc-4-methanesulfonylamino-L-phenylalanine

Chemical Property:

• PKA: 3.76±0.10(Predicted)
• PSA: 130.18000
• Density: 1.397±0.06 g/cm3(Predicted)
• LogP: 5.13720
• XLogP3: 3.6
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 9
• Exact Mass: 480.13550766
• Heavy Atom Count: 34
• Complexity: 798

Purity/Quality:

98.5% ^*data from raw suppliers

(S)-2-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)-3-(4-(methylsulfonamido)phenyl)propanoicacid 95+% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CS(=O)(=O)NC1=CC=C(C=C1)CC(C(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24
• Isomeric SMILES: CS(=O)(=O)NC1=CC=C(C=C1)C[C@@H](C(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24