91-87-2
Product Name:
FEMA 2062
Formula:
C16H24O2
Synonyms:
α-Pentylcinnamaldehyde dimethyl acetal;[2-(Dimethoxymethyl)-1-hepten-1-yl]benzene
Inquiry
CHEMICAL AND PHYSICAL PROPERTIES
Physical Description | Almost colourless to pale yellow, floral odour reminiscent of jasmine |
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Solubility | slightly soluble in water |
Density | 0.954-0.963 |
Refractive Index | 1.504-1.511 |
SAFETY INFORMATION
Signal word | Warning |
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Pictogram(s) |
Exclamation Mark Irritant GHS07 |
GHS Hazard Statements |
H315:Skin corrosion/irritation H319:Serious eye damage/eye irritation H335:Specific target organ toxicity, single exposure;Respiratory tract irritation |
Precautionary Statement Codes |
P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. |
COMPUTED DESCRIPTORS
Molecular Weight | 248.36 g/mol |
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XLogP3 | 4.9 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 2 |
Rotatable Bond Count | 8 |
Exact Mass | 248.177630004 g/mol |
Monoisotopic Mass | 248.177630004 g/mol |
Topological Polar Surface Area | 18.5 Ų |
Heavy Atom Count | 18 |
Formal Charge | 0 |
Complexity | 225 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 0 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 1 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Compound Is Canonicalized | Yes |