2-Pentanone, 5-(acetyloxy)-3-chloro-


Chemical Name: 2-Pentanone, 5-(acetyloxy)-3-chloro-
CAS Number: 13051-49-5
Product Number: AG000UJ2(AGN-PC-094K0U)
Synonyms:
MDL No:
Molecular Formula: C7H11ClO3
Molecular Weight: 178.6134

Identification/Properties


Computed Properties
Molecular Weight:
178.612g/mol
XLogP3:
0.9
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
5
Exact Mass:
178.04g/mol
Monoisotopic Mass:
178.04g/mol
Topological Polar Surface Area:
43.4A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
156
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


Request for Quotation


Customer Feedback