7-(chloromethyl)-3,4-dihydro-2H-1,5-benzodioxepine

Base Information

• Chemical Name: 7-(chloromethyl)-3,4-dihydro-2H-1,5-benzodioxepine
• CAS No.: 67869-70-9
• Molecular Formula: C10H11ClO2
• Molecular Weight: 198.65
• Hs Code.: 2932999099
• DSSTox Substance ID: DTXSID50380046
• Wikidata: Q82170071
• Mol file: 67869-70-9.mol

Synonyms:67869-70-9;7-(chloromethyl)-3,4-dihydro-2H-1,5-benzodioxepine;7-(chloromethyl)-3,4-dihydro-2H-benzo[b][1,4]dioxepine;SCHEMBL1174021;DTXSID50380046;PXZCFOABYOEFPQ-UHFFFAOYSA-N;MFCD03011383;AKOS002662840;AC-9361;AS-31411;CS-0250239;FT-0621324;EN300-50221;A867171;J-519036;7-(Chloromethyl)-3,4-dihydro-2H-1,5-benzodioxepine, AldrichCPR

Chemical Property of 7-(chloromethyl)-3,4-dihydro-2H-1,5-benzodioxepine

Chemical Property:

• Vapor Pressure: 0.003mmHg at 25°C
• Refractive Index: 1.54
• Boiling Point: 296.429 °C at 760 mmHg
• Flash Point: 123.16 °C
• PSA: 18.46000
• Density: 1.213 g/cm³
• LogP: 2.58670
• Storage Temp.: 2-8°C
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 198.0447573
• Heavy Atom Count: 13
• Complexity: 163

Purity/Quality:

98%min ^*data from raw suppliers

7-(chloromethyl)-3,4-dihydro-2H-1,5-benzodioxepine ^*data from reagent suppliers

Safty Information:

• Pictogram(s): C
• Hazard Codes: C
• Statements: 36
• Safety Statements: 26

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1COC2=C(C=C(C=C2)CCl)OC1