Home Aldehydes 2-(3,4-Dimethoxyphenyl)acetaldehyde

2-(3,4-Dimethoxyphenyl)acetaldehyde

CAS No.:
5703-21-9
Catalog Number:
AG0037LM
Molecular Formula:
C10H12O3
Molecular Weight:
180.2005
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Purity
Availability
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Quantity
  
5g
95%
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United States
$1258
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Product Description
Catalog Number:
AG0037LM
Chemical Name:
2-(3,4-Dimethoxyphenyl)acetaldehyde
CAS Number:
5703-21-9
Molecular Formula:
C10H12O3
Molecular Weight:
180.2005
MDL Number:
MFCD02261749
IUPAC Name:
2-(3,4-dimethoxyphenyl)acetaldehyde
InChI:
InChI=1S/C10H12O3/c1-12-9-4-3-8(5-6-11)7-10(9)13-2/h3-4,6-7H,5H2,1-2H3
InChI Key:
RIVVYJWUHXMGSK-UHFFFAOYSA-N
SMILES:
O=CCc1ccc(c(c1)OC)OC
EC Number:
227-189-4
UNII:
CS521IRB51
Properties
Complexity:
158  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
180.079g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
180.203g/mol
Monoisotopic Mass:
180.079g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.9  
Literature
Title Journal
Contribution of aldehyde oxidizing enzymes on the metabolism of 3,4-dimethoxy-2-phenylethylamine to 3,4-dimethoxyphenylacetic acid by guinea pig liver slices. Cellular physiology and biochemistry : international journal of experimental cellular physiology, biochemistry, and pharmacology 20060101
Properties