Butyric acid, 2-chloro-, 2-(1-methylheptyl)-4,6-dinitrophenyl ester

Base Information

• Chemical Name: Butyric acid, 2-chloro-, 2-(1-methylheptyl)-4,6-dinitrophenyl ester
• CAS No.: 2411-01-0
• Molecular Formula: C18H25 Cl N2 O6
• Molecular Weight: 400.8539
• DSSTox Substance ID: DTXSID40946938
• Nikkaji Number: J42.779I
• Mol file: 2411-01-0.mol

Synonyms:ENT 27,327-X;NSC 190927;Thompson-hayward T-H 093-F;T-H 093-F;2411-01-0;BUTYRIC ACID, 2-CHLORO-, 2-(1-METHYLHEPTYL)-4,6-DINITROPHENYL ESTER;C18H25ClN2O6;DTXSID40946938;C18-H25-Cl-N2-O6;LS-47917;(2,4-Dinitro-6-octan-2-ylphenyl)2-chlorobutanoate;2,4-DINITRO-6-(OCTAN-2-YL)PHENYL 2-CHLOROBUTANOATE;2-Chlorobutanoic acid 2-(1-methylheptyl)-4,6-dinitrophenyl ester;Butanoic acid, 2-chloro-, 2-(1-methylheptyl)-4,6-dinitrophenyl ester

Chemical Property of Butyric acid, 2-chloro-, 2-(1-methylheptyl)-4,6-dinitrophenyl ester

Chemical Property:

• Vapor Pressure: 7.03E-09mmHg at 25°C
• Boiling Point: 466.5°Cat760mmHg
• Flash Point: 235.9°C
• PSA: 117.94000
• Density: 1.221g/cm³
• LogP: 6.54610
• XLogP3: 6.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 10
• Exact Mass: 400.1401142
• Heavy Atom Count: 27
• Complexity: 507

Purity/Quality:

97% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCCC(C)C1=C(C(=CC(=C1)[N+](=O)[O-])[N+](=O)[O-])OC(=O)C(CC)Cl