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Home Aminos (2E)-3-(dimethylamino)-1-(2-hydroxyphenyl)prop-2-en-1-one

(2E)-3-(dimethylamino)-1-(2-hydroxyphenyl)prop-2-en-1-one

CAS No.:
106129-86-6
Catalog Number:
AG007VLM
Molecular Formula:
C11H13NO2
Molecular Weight:
191.2264
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$150
- +
5g
96%
In Stock USA
United States
$450
- +
10g
96%
In Stock USA
United States
$750
- +
Product Description
Catalog Number:
AG007VLM
Chemical Name:
(2E)-3-(dimethylamino)-1-(2-hydroxyphenyl)prop-2-en-1-one
CAS Number:
106129-86-6
Molecular Formula:
C11H13NO2
Molecular Weight:
191.2264
MDL Number:
MFCD00172108
IUPAC Name:
(E)-3-(dimethylamino)-1-(2-hydroxyphenyl)prop-2-en-1-one
InChI:
InChI=1S/C11H13NO2/c1-12(2)8-7-11(14)9-5-3-4-6-10(9)13/h3-8,13H,1-2H3/b8-7+
InChI Key:
SVBCOAAIOJDZNC-BQYQJAHWSA-N
SMILES:
CN(/C=C/C(=O)c1ccccc1O)C
Properties
Complexity:
223  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
1  
Exact Mass:
191.095g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
191.23g/mol
Monoisotopic Mass:
191.095g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.3  
Literature
Title Journal
Identification of a Chemical Probe for Family VIII Bromodomains through Optimization of a Fragment Hit. Journal of medicinal chemistry 20160526
Properties