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39192-51-3

39192-51-3 structural image
Product Name: 1-(3 5-DIMETHOXYPHENYL)HEPTAN-1-ONE 96
Formula: C15H22O3
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SAFETY INFORMATION

Signal word Danger
Pictogram(s)

Skull and Crossbones
Acute Toxicity
GHS06
GHS Hazard Statements H301:Acute toxicity,oral
H317:Sensitisation, Skin
H413:Hazardous to the aquatic environment, long-term hazard
Precautionary Statement Codes P280:Wear protective gloves/protective clothing/eye protection/face protection.
P301+P310:IF SWALLOWED: Immediately call a POISON CENTER or doctor/physician.

COMPUTED DESCRIPTORS

Molecular Weight 250.33 g/mol
XLogP3 4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 8
Exact Mass 250.15689456 g/mol
Monoisotopic Mass 250.15689456 g/mol
Topological Polar Surface Area 35.5 Ų
Heavy Atom Count 18
Formal Charge 0
Complexity 228
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