4-(Dimethylamino)cinnamaldehyde - CAS 6203-18-5
Catalog: |
BB031390 |
Product Name: |
4-(Dimethylamino)cinnamaldehyde |
CAS: |
6203-18-5 |
Synonyms: |
(E)-3-[4-(dimethylamino)phenyl]prop-2-enal |
IUPAC Name: | (E)-3-[4-(dimethylamino)phenyl]prop-2-enal |
Description: | 4-(Dimethylamino)cinnamaldehyde (CAS# 6203-18-5) is a useful research chemical. Dyes and metabolites. |
Molecular Weight: | 175.23 |
Molecular Formula: | C11H13NO |
Canonical SMILES: | CN(C)C1=CC=C(C=C1)C=CC=O |
InChI: | InChI=1S/C11H13NO/c1-12(2)11-7-5-10(6-8-11)4-3-9-13/h3-9H,1-2H3/b4-3+ |
InChI Key: | RUKJCCIJLIMGEP-ONEGZZNKSA-N |
Boiling Point: | 328.9 °C at 760 mmHg |
Melting Point: | 138-141 °C |
Purity: | 95 % |
Density: | 1.057 g/cm3 |
Appearance: | Deep yellow fine crystals |
Storage: | -20 °C |
MDL: | MFCD00007002 |
LogP: | 1.96470 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
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PMID | Publication Date | Title | Journal |
22583500 | 20120601 | Forensic identification of urine using the DMAC test: a method validation study | Science & justice : journal of the Forensic Science Society |
22533362 | 20120509 | Comparison of isolated cranberry (Vaccinium macrocarpon Ait.) proanthocyanidins to catechin and procyanidins A2 and B2 for use as standards in the 4-(dimethylamino)cinnamaldehyde assay | Journal of agricultural and food chemistry |
21813253 | 20120110 | Chemical enhancement of footwear impressions in urine on fabric | Forensic science international |
21689973 | 20110901 | A simple and green analytical method for determination of glyphosate in commercial formulations and water by diffuse reflectance spectroscopy | Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy |
20121464 | 20110601 | Use of stains to detect fingermarks | Biotechnic & histochemistry : official publication of the Biological Stain Commission |
Complexity: | 179 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 1 |
Exact Mass: | 175.099714038 |
Formal Charge: | 0 |
Heavy Atom Count: | 13 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 175.099714038 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 20.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
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