Home Bromides 49619-82-1
49619-82-1,MFCD00017337
Catalog No.:AA003IZ3
49619-82-1 | 3-Bromochromone
Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
97%
in stock  
$29.00   $20.00
- +
5g
97%
in stock  
$129.00   $90.00
- +
25g
97%
in stock  
$366.00   $256.00
- +
100g
97%
in stock  
$1,080.00   $756.00
- +
  • Technical Information
  • Properties
  • Literature
  • Request for Quotation
  • Q & A
  • Technical Information
  • Properties
  • Literature
Technical Information
Catalog Number:
AA003IZ3
Chemical Name:
3-Bromochromone
CAS Number:
49619-82-1
Molecular Formula:
C9H5BrO2
Molecular Weight:
225.0388
MDL Number:
MFCD00017337
IUPAC Name:
3-bromochromen-4-one
InChI:
InChI=1S/C9H5BrO2/c10-7-5-12-8-4-2-1-3-6(8)9(7)11/h1-5H
InChI Key:
IQIGYNPOESZBDJ-UHFFFAOYSA-N
SMILES:
O=c1c(Br)coc2c1cccc2
Properties
Computed Properties
 
Complexity:
235  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.947g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
225.041g/mol
Monoisotopic Mass:
223.947g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  

Synonyms
 
3-Bromochromone 
49619-82-1 
Maybridge1_006104 
ACMC-209kh2 
SCHEMBL312373 
3-Bromo-4H-chromen-4-one # 
CTK3J2402 
HMS558N10 
ZINC57933 
DTXSID80334592 
3-Bromo-4H-1-benzopyran-4-one 
ACT07914 
3-Bromo-4H-chromen-4-one 
ZX-AT027147 
ANW-30804 
SBB096767 
AKOS005199054 
ACN-049194 
CCG-248981 
FCH1321452 
MCULE-9598593948 
ACM49619821 
KS-000013D2 
3-bromochromen-4-one 
AJ-09795 
AS-18862 
SC-52488 
ZB002280 
AX8085313 
DB-051657 
B3334 
FT-0615218 
ST50309075 
X2974 
3-Bromo-4-oxo-4H-1-benzopyran 
A-7821 
C-57725 
I14-49749 
C9H5BrO2 
CID521256 
ZINC00057933 
MFCD00017337 
IQIGYNPOESZBDJ-UHFFFAOYSA-N 
3-Bromo chromone 
AC1LAVCI 
3-Bromochromone, 97% 
Literature

Title: Inhibition of cancer cell invasion and metastasis by genistein.

Journal: Cancer metastasis reviews 20100901

Title: The first total synthesis of kwakhurin, a characteristic component of a rejuvenating plant, 'kwao keur': toward an efficient synthetic route to phytoestrogenic isoflavones.

Journal: Organic & biomolecular chemistry 20050221

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