(3S)-3-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}-4-(furan-2-yl)butanoic acid

Base Information

• Chemical Name: (3S)-3-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}-4-(furan-2-yl)butanoic acid
• CAS No.: 270263-07-5
• Molecular Formula: C23H21NO5
• Molecular Weight: 391.42
• DSSTox Substance ID: DTXSID601156907
• Mol file: 270263-07-5.mol

Synonyms:270263-07-5;FMOC-(S)-3-Amino-4-(2-furyl)-butyric acid;(3S)-3-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}-4-(furan-2-yl)butanoic acid;Fmoc-(2-furyl)-L-beta-homoalanine;(S)-3-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)-4-(furan-2-yl)butanoic acid;Fmoc-(S)-3-amino-4-(2-furyl)butyric acid;Fmoc-(2-furyl)-D-beta-homoalanine;Fmoc-(2-furyl)-L-b-homoalanine;SCHEMBL799772;DTXSID601156907;MFCD01861091;AKOS015948755;PS-12334;E70604;Fmoc-(S)-3-amino-4-(2-furyl)-butyric acid, AldrichCPR;(3S)-3-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-4-(furan-2-yl)butanoic acid;(betaS)-beta-[[(9H-Fluoren-9-ylmethoxy)carbonyl]amino]-2-furanbutanoic acid;(S)-3-((((9H-fluoren-9-yl)methoxy)carbonyl)amino)-4-(furan-2-yl)butanoicacid;(S)-3-(((9H-fluoren-9-yl)methoxy)carbonylamino)-4-(furan-2-yl)butanoic acid

Chemical Property of (3S)-3-{[(9H-fluoren-9-ylmethoxy)carbonyl]amino}-4-(furan-2-yl)butanoic acid

Chemical Property:

• Vapor Pressure: 4.72E-16mmHg at 25°C
• Refractive Index: 1.612
• Boiling Point: 616.4 °C at 760 mmHg
• PKA: 4.34±0.10(Predicted)
• Flash Point: 326.6 °C
• PSA: 88.77000
• Density: 1.292 g/cm³
• LogP: 4.59500
• XLogP3: 3.7
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 8
• Exact Mass: 391.14197277
• Heavy Atom Count: 29
• Complexity: 560

Purity/Quality:

98%min ^*data from raw suppliers

Fmoc-(S)-3-amino-4-(2-furyl)-butyric acid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)NC(CC4=CC=CO4)CC(=O)O
• Isomeric SMILES: C1=CC=C2C(=C1)C(C3=CC=CC=C32)COC(=O)N[C@@H](CC4=CC=CO4)CC(=O)O