4-Heptanone, 1,7-dichloro-


Chemical Name: 4-Heptanone, 1,7-dichloro-
CAS Number: 40624-07-5
Product Number: AG003DRM(AGN-PC-0JOJI0)
Synonyms:
MDL No: MFCD00019001
Molecular Formula: C7H12Cl2O
Molecular Weight: 183.0756

Identification/Properties


Properties
BP:
264.8°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Liquid
Computed Properties
Molecular Weight:
183.072g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
1
Rotatable Bond Count:
6
Exact Mass:
182.027g/mol
Monoisotopic Mass:
182.027g/mol
Topological Polar Surface Area:
17.1A^2
Heavy Atom Count:
10
Formal Charge:
0
Complexity:
83.6
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302+H312+H332-H315-H319-H335
Precautionary Statements:
P261-P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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