Benzeneacetyl chloride, 4-chloro-a-(1-methylethyl)-


Chemical Name: Benzeneacetyl chloride, 4-chloro-a-(1-methylethyl)-
CAS Number: 51631-50-6
Product Number: AG003B2B(AGN-PC-0SAVWA)
Synonyms:
MDL No:
Molecular Formula: C11H12Cl2O
Molecular Weight: 231.1184

Identification/Properties


Properties
BP:
290.6°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Refractive Index:
n20/D 1.526(lit.)
Computed Properties
Molecular Weight:
231.116g/mol
XLogP3:
4.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
3
Exact Mass:
230.027g/mol
Monoisotopic Mass:
230.027g/mol
Topological Polar Surface Area:
17.1A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
196
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


NMR Spectrum


Other Analytical Data


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