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Home Other Building Blocks 3',4'-(Methylenedioxy)acetophenone

3',4'-(Methylenedioxy)acetophenone

CAS No.:
3162-29-6
Catalog Number:
AG003D21
Molecular Formula:
C9H8O3
Molecular Weight:
164.1580
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
98%
In Stock USA
United States
$19
- +
25g
98%
In Stock USA
United States
$50
- +
100g
98%
In Stock USA
United States
$150
- +
Product Description
Catalog Number:
AG003D21
Chemical Name:
3',4'-(Methylenedioxy)acetophenone
CAS Number:
3162-29-6
Molecular Formula:
C9H8O3
Molecular Weight:
164.1580
MDL Number:
MFCD00005831
IUPAC Name:
1-(1,3-benzodioxol-5-yl)ethanone
InChI:
InChI=1S/C9H8O3/c1-6(10)7-2-3-8-9(4-7)12-5-11-8/h2-4H,5H2,1H3
InChI Key:
BMHMKWXYXFBWMI-UHFFFAOYSA-N
SMILES:
CC(=O)c1ccc2c(c1)OCO2
EC Number:
221-613-1
UNII:
8JG2OH2M57
NSC Number:
21866
Properties
Complexity:
190  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
164.047g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
164.16g/mol
Monoisotopic Mass:
164.047g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.6  
Literature
Title Journal
(2E)-1-(1,3-Benzodioxol-5-yl)-3-(2-bromo-phen-yl)prop-2-en-1-one. Acta crystallographica. Section E, Structure reports online 20100601
1-(1,3-Benzodioxol-5-yl)ethanone. Acta crystallographica. Section E, Structure reports online 20100201
(E)-1-(1,3-Benzodioxol-5-yl)-3-(3-bromo-phen-yl)prop-2-en-1-one. Acta crystallographica. Section E, Structure reports online 20081201
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
Propolis from Chilean matorral hives. Zeitschrift fur Naturforschung. C, Journal of biosciences 20010101
Properties