N-((5-(Dimethylamino)-1-naphthyl)sulphonyl)-L-histidine

Base Information

• Chemical Name: N-((5-(Dimethylamino)-1-naphthyl)sulphonyl)-L-histidine
• CAS No.: 7293-13-2
• Molecular Formula: C18H20N4O4S
• Molecular Weight: 388.4408
• European Community (EC) Number: 230-726-5
• DSSTox Substance ID: DTXSID50223222
• Nikkaji Number: J212.290A
• Mol file: 7293-13-2.mol

Synonyms:EINECS 230-726-5;7293-13-2;N-((5-(Dimethylamino)-1-naphthyl)sulphonyl)-L-histidine;C18H20N4O4S;L-Histidine, N-((5-(dimethylamino)-1-naphthalenyl)sulfonyl)-;dansyl-histidine;N-[[5-(DIMETHYLAMINO)-1-NAPHTHYL]SULPHONYL]-L-HISTIDINE;SCHEMBL7034219;DTXSID50223222

Chemical Property of N-((5-(Dimethylamino)-1-naphthyl)sulphonyl)-L-histidine

Chemical Property:

• Vapor Pressure: 5.69E-20mmHg at 25°C
• Boiling Point: 689.7°C at 760 mmHg
• Flash Point: 370.9°C
• PSA: 123.77000
• Density: 1.426g/cm³
• LogP: 3.07480
• XLogP3: 2
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 7
• Exact Mass: 388.12052631
• Heavy Atom Count: 27
• Complexity: 621

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)NC(CC3=CN=CN3)C(=O)O
• Isomeric SMILES: CN(C)C1=CC=CC2=C1C=CC=C2S(=O)(=O)N[C@@H](CC3=CN=CN3)C(=O)O

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