4-({[3-(2-Chloro-4-nitrophenoxy)propyl]carbamoyl}amino)-2-methylbenzenesulfonyl fluoride

Base Information

• Chemical Name: 4-({[3-(2-Chloro-4-nitrophenoxy)propyl]carbamoyl}amino)-2-methylbenzenesulfonyl fluoride
• CAS No.: 25313-30-8
• Molecular Formula: C17H17 Cl F N3 O6 S
• Molecular Weight: 445.8498
• NSC Number: 132098
• DSSTox Substance ID: DTXSID50299689
• Wikidata: Q82042202
• Mol file: 25313-30-8.mol

Synonyms:25313-30-8;4-(3-(3-(2-Chloro-4-nitrophenoxy)propyl)ureido)-2-methylbenzene-1-sulfonyl fluoride;NSC132098;4-({[3-(2-chloro-4-nitrophenoxy)propyl]carbamoyl}amino)-2-methylbenzenesulfonyl fluoride;starbld0019505;DTXSID50299689;NSC-132098

Chemical Property of 4-({[3-(2-Chloro-4-nitrophenoxy)propyl]carbamoyl}amino)-2-methylbenzenesulfonyl fluoride

Chemical Property:

• Vapor Pressure: 1.06E-13mmHg at 25°C
• Boiling Point: 585.7°C at 760 mmHg
• Flash Point: 308°C
• Density: 1.468g/cm³
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 7
• Exact Mass: 445.0510623
• Heavy Atom Count: 29
• Complexity: 671

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
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MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C=CC(=C1)NC(=O)NCCCOC2=C(C=C(C=C2)[N+](=O)[O-])Cl)S(=O)(=O)F

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