[4-({[(9H-Fluoren-9-yl)methoxy]carbonyl}amino)tetrahydro-2H-thiopyran-4-yl]acetic acid

Base Information

• Chemical Name: [4-({[(9H-Fluoren-9-yl)methoxy]carbonyl}amino)tetrahydro-2H-thiopyran-4-yl]acetic acid
• CAS No.: 946727-62-4
• Molecular Formula: C22H23NO4S
• Molecular Weight: 397.48732
• Hs Code.: 2934999090
• DSSTox Substance ID: DTXSID20589241
• Wikidata: Q82482480
• Mol file: 946727-62-4.mol

Synonyms:946727-62-4;[4-({[(9H-Fluoren-9-yl)methoxy]carbonyl}amino)tetrahydro-2H-thiopyran-4-yl]acetic acid;(4-Fmoc-amino-tetrahydrothiopyran-4-yl)acetic acid;(4-Fmoc-amino-tetrahydrothiopyran-4-yl)-acetic acid;2-[4-(9H-fluoren-9-ylmethoxycarbonylamino)thian-4-yl]acetic acid;2-[4-({[(9H-FLUOREN-9-YL)METHOXY]CARBONYL}AMINO)THIAN-4-YL]ACETIC ACID;2-(4-((((9H-Fluoren-9-yl)methoxy)carbonyl)amino)tetrahydro-2H-thiopyran-4-yl)acetic acid;DTXSID20589241;MFCD09264207;AKOS025404057;PS-10978;CS-0211646;E70806;EN300-650847;(4-Fmoc-amino-tetrahydrothiopyran-4-yl)aceticacid;[4-({[(9H-Fluoren-9-yl)methoxy]carbonyl}amino)thian-4-yl]acetic acid;[4-Amino(tetrahydro-2H-thiopyran-4-yl)]acetic acid, N-FMOC protected

Chemical Property of [4-({[(9H-Fluoren-9-yl)methoxy]carbonyl}amino)tetrahydro-2H-thiopyran-4-yl]acetic acid

Chemical Property:

• Boiling Point: 643.6±48.0 °C(Predicted)
• PKA: 4.59±0.10(Predicted)
• PSA: 104.42000
• Density: 1.34±0.1 g/cm3(Predicted)
• LogP: 4.47000
• XLogP3: 4.1
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 6
• Exact Mass: 397.13477939
• Heavy Atom Count: 28
• Complexity: 555

Purity/Quality:

97% ^*data from raw suppliers

[4-({[(9H-Fluoren-9-yl)methoxy]carbonyl}amino)tetrahydro-2H-thiopyran-4-yl]acetic acid ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CSCCC1(CC(=O)O)NC(=O)OCC2C3=CC=CC=C3C4=CC=CC=C24