Dodecyl aldehyde - CAS 112-54-9
Catalog: |
BB002994 |
Product Name: |
Dodecyl aldehyde |
CAS: |
112-54-9 |
Synonyms: |
dodecanal |
IUPAC Name: | dodecanal |
Description: | Dodecyl aldehyde (CAS# 112-54-9) is a fragrance agent that is found in soaps, perfumes as well as in food flavoring materials. |
Molecular Weight: | 184.32 |
Molecular Formula: | C12H24O |
Canonical SMILES: | CCCCCCCCCCCC=O |
InChI: | InChI=1S/C12H24O/c1-2-3-4-5-6-7-8-9-10-11-12-13/h12H,2-11H2,1H3 |
InChI Key: | HFJRKMMYBMWEAD-UHFFFAOYSA-N |
Boiling Point: | 237-239 °C |
Melting Point: | 12°C |
Flash Point: | 101°C |
Purity: | 95 % |
Density: | 0.831 g/cm3 |
Appearance: | Colourless liquid |
Storage: | Inert atmosphere, Store in freezer, under -20 °C |
MDL: | MFCD00007017 |
LogP: | 4.10620 |
Refractive Index: | 1.433-1.44 |
Stability: | Stable. Combustible. Incompatible with strong oxidizing agents, strong reducing agents, strong bases. |
Vapor Pressure: | 0.01 [mmHg] |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P272, P273, P280, P302+P352, P305+P351+P338, P321, P332+P313, P333+P313, P337+P313, P362, P363, P391, and P501 |
Signal Word: | Warning |
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PMID | Publication Date | Title | Journal |
23058790 | 20121201 | Periovulatory changes in the endoscopic appearance of the reproductive tract and teasing behavior in the bitch | Theriogenology |
22743183 | 20121101 | Ecotoxicity and biodegradability of antielectrostatic dicephalic cationic surfactants | Chemosphere |
22785262 | 20121101 | Vulval tumor in an infant: prolapse of ureterocele | The Journal of pediatrics |
22854262 | 20121101 | Nonionic diethanolamide amphiphiles with saturated hydrocarbon chains: neat crystalline and lyotropic liquid crystalline phase behavior | Journal of colloid and interface science |
22883922 | 20121001 | The burden of health associated with benign gynecological disorders in low-resource settings | International journal of gynaecology and obstetrics: the official organ of the International Federation of Gynaecology and Obstetrics |
Complexity: | 99.3 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 184.182715385 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 184.182715385 |
Rotatable Bond Count: | 10 |
Topological Polar Surface Area: | 17.1 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 4.9 |
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