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Home Aldehydes 6-Bromoveratraldehyde

6-Bromoveratraldehyde

CAS No.:
5392-10-9
Catalog Number:
AG003358
Molecular Formula:
C9H9BrO3
Molecular Weight:
245.0700
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
5g
98%
In Stock USA
United States
$13
- +
25g
98%
In Stock USA
United States
$38
- +
100g
98%
In Stock USA
United States
$100
- +
500g
98%
In Stock USA
United States
$350
- +
Product Description
Catalog Number:
AG003358
Chemical Name:
6-Bromoveratraldehyde
CAS Number:
5392-10-9
Molecular Formula:
C9H9BrO3
Molecular Weight:
245.0700
MDL Number:
MFCD00003301
IUPAC Name:
2-bromo-4,5-dimethoxybenzaldehyde
InChI:
InChI=1S/C9H9BrO3/c1-12-8-3-6(5-11)7(10)4-9(8)13-2/h3-5H,1-2H3
InChI Key:
UQQROBHFUDBOOK-UHFFFAOYSA-N
SMILES:
COc1cc(C=O)c(cc1OC)Br
EC Number:
226-390-4
NSC Number:
3254
Properties
Complexity:
174  
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:
0
Isotope Atom Count:
0
Molecular Weight:
245.072g/mol
Monoisotopic Mass:
243.974g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
35.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2  
Literature
Title Journal
Modulation of DNA repair by pharmacological inhibitors of the PIKK protein kinase family. Bioorganic & medicinal chemistry letters 20120901
Multiple tyrosine metabolites are GPR35 agonists. Scientific reports 20120101
Methyl (E)-3-(2-bromo-4,5-dimeth-oxy-benzyl-idene)dithio-carbazate. Acta crystallographica. Section E, Structure reports online 20111101
Properties