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Home Other Building Blocks 3-(3,4-Dimethoxyphenyl)propionic acid

3-(3,4-Dimethoxyphenyl)propionic acid

CAS No.:
2107-70-2
Catalog Number:
AG002KXO
Molecular Formula:
C11H14O4
Molecular Weight:
210.2265
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
98%
In Stock USA
United States
$13
- +
25g
98%
In Stock USA
United States
$25
- +
100g
98%
In Stock USA
United States
$69
- +
500g
98%
In Stock USA
United States
$250
- +
Product Description
Catalog Number:
AG002KXO
Chemical Name:
3-(3,4-Dimethoxyphenyl)propionic acid
CAS Number:
2107-70-2
Molecular Formula:
C11H14O4
Molecular Weight:
210.2265
MDL Number:
MFCD00002774
IUPAC Name:
3-(3,4-dimethoxyphenyl)propanoic acid
InChI:
InChI=1S/C11H14O4/c1-14-9-5-3-8(4-6-11(12)13)7-10(9)15-2/h3,5,7H,4,6H2,1-2H3,(H,12,13)
InChI Key:
LHHKQWQTBCTDQM-UHFFFAOYSA-N
SMILES:
COc1cc(CCC(=O)O)ccc1OC
EC Number:
218-288-3
UNII:
6XO32ZSP1D
NSC Number:
76043
Properties
Complexity:
205  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.089g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
210.229g/mol
Monoisotopic Mass:
210.089g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
55.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.2  
Literature
Title Journal
Structure-anti-leukemic activity relationship study of ortho-dihydroxycoumarins in U-937 cells: key role of the δ-lactone ring in determining differentiation-inducing potency and selective pro-apoptotic action. Bioorganic & medicinal chemistry 20120915
Microsphere-based protease assays and screening application for lethal factor and factor Xa. Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501
Properties