sales@angenesci.com
Login | Register
logo
Structures Search
Home Other Building Blocks 1-(5-Bromo-2-hydroxy-4-methoxyphenyl)-ethanone

1-(5-Bromo-2-hydroxy-4-methoxyphenyl)-ethanone

CAS No.:
39503-61-2
Catalog Number:
AG00CRDA
Molecular Formula:
C9H9BrO3
Molecular Weight:
245.0700
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$138
- +
1g
95%
In Stock USA
United States
$343
- +
5g
95%
In Stock USA
United States
$1028
- +
Product Description
Catalog Number:
AG00CRDA
Chemical Name:
1-(5-Bromo-2-hydroxy-4-methoxyphenyl)-ethanone
CAS Number:
39503-61-2
Molecular Formula:
C9H9BrO3
Molecular Weight:
245.0700
MDL Number:
MFCD00597545
IUPAC Name:
1-(5-bromo-2-hydroxy-4-methoxyphenyl)ethanone
InChI:
InChI=1S/C9H9BrO3/c1-5(11)6-3-7(10)9(13-2)4-8(6)12/h3-4,12H,1-2H3
InChI Key:
KFFNBIVASILHIH-UHFFFAOYSA-N
SMILES:
COc1cc(O)c(cc1Br)C(=O)C
Properties
Complexity:
195  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
243.974g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
245.072g/mol
Monoisotopic Mass:
243.974g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Literature
Title Journal
Stereoselective bioreduction of 1-(4-methoxyphenyl)ethanone by whole cells of marine-derived fungi. Marine biotechnology (New York, N.Y.) 20120601
1-(5-bromo-2-hydroxy-4-methoxyphenyl)ethanone [SE1] suppresses pro-inflammatory responses by blocking NF-κB and MAPK signaling pathways in activated microglia. European journal of pharmacology 20111130
Properties