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3,4-Dimethoxycinnamyl alcohol - ≥97%, high purity , CAS No.40918-90-9

    Grade & Purity:
  • ≥97%
In stock
Item Number
D692110
Grouped product items
SKU Size
Availability
Price Qty
D692110-5mg
5mg
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
$866.90

Basic Description

Specifications & Purity ≥97%

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
Superclass Benzenoids
Class Benzene and substituted derivatives
Subclass Methoxybenzenes
Intermediate Tree Nodes Not available
Direct Parent Dimethoxybenzenes
Alternative Parents Cinnamyl alcohols  Styrenes  Phenoxy compounds  Anisoles  Alkyl aryl ethers  Primary alcohols  Hydrocarbon derivatives  
Molecular Framework Aromatic homomonocyclic compounds
Substituents O-dimethoxybenzene - Dimethoxybenzene - Cinnamyl alcohol - Phenoxy compound - Styrene - Phenol ether - Anisole - Alkyl aryl ether - Ether - Organic oxygen compound - Hydrocarbon derivative - Primary alcohol - Organooxygen compound - Alcohol - Aromatic homomonocyclic compound
Description This compound belongs to the class of organic compounds known as dimethoxybenzenes. These are organic aromatic compounds containing a monocyclic benzene moiety carrying exactly two methoxy groups.
External Descriptors primary alcohol - dimethoxybenzene

Product Properties

ALogP 1.3

Associated Targets(Human)

ACHN (49357 Activities)
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COLO 205 (50209 Activities)
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DMS-273 (14108 Activities)
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HT-29 (80576 Activities)
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K562 (73714 Activities)
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KM12 (47707 Activities)
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MOLT-4 (49676 Activities)
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OVCAR-3 (48710 Activities)
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OVCAR-5 (45555 Activities)
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OVCAR-8 (47708 Activities)
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RPMI-8226 (44974 Activities)
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RXF 393 (41971 Activities)
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SF-295 (48000 Activities)
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SK-MEL-2 (46422 Activities)
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SK-MEL-28 (48833 Activities)
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SK-MEL-5 (47095 Activities)
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SK-OV-3 (52876 Activities)
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SN12C (47755 Activities)
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SNB-19 (46794 Activities)
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SNB-78 (14240 Activities)
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TK-10 (45540 Activities)
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U-251 (51189 Activities)
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UACC-257 (46019 Activities)
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UACC-62 (47335 Activities)
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UO-31 (46270 Activities)
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786-0 (47912 Activities)
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A549 (127892 Activities)
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EKVX (44102 Activities)
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NCI-H322M (45589 Activities)
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HCC 2998 (41480 Activities)
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HOP-92 (41141 Activities)
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SF-268 (49410 Activities)
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IGROV-1 (47897 Activities)
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KM-20L2 (14967 Activities)
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LXFL 529 (14112 Activities)
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M19-MEL (15326 Activities)
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HeLa (62764 Activities)
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Malme-3M (44254 Activities)
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SNB-75 (44215 Activities)
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NCI-H226 (44470 Activities)
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NCI-H23 (49055 Activities)
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SF-539 (44845 Activities)
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SR (39847 Activities)
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SW-620 (52400 Activities)
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HCT-15 (51914 Activities)
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Associated Targets(non-human)

rhinovirus A39 (46 Activities)
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rhinovirus B14 (1052 Activities)
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Mechanisms of Action

Mechanism of Action Action Type target ID Target Name Target Type Target Organism Binding Site Name References

Names and Identifiers

IUPAC Name (E)-3-(3,4-dimethoxyphenyl)prop-2-en-1-ol
INCHI InChI=1S/C11H14O3/c1-13-10-6-5-9(4-3-7-12)8-11(10)14-2/h3-6,8,12H,7H2,1-2H3/b4-3+
InChIKey OYICGYUCCHVYRR-ONEGZZNKSA-N
Smiles COC1=C(C=C(C=C1)C=CCO)OC
Isomeric SMILES COC1=C(C=C(C=C1)/C=C/CO)OC
PubChem CID 5387770
Molecular Weight 194.23

Certificates(CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Chemical and Physical Properties

Molecular Weight 194.230 g/mol
XLogP3 1.300
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 4
Exact Mass 194.094 Da
Monoisotopic Mass 194.094 Da
Topological Polar Surface Area 38.700 Ų
Heavy Atom Count 14
Formal Charge 0
Complexity 179.000
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
The total count of all stereochemical bonds 1
Covalently-Bonded Unit Count 1

Solution Calculators

Reviews

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