Home Carboxys 6-Bromochromane-2-carboxylic acid

6-Bromochromane-2-carboxylic acid

CAS No.:
99199-54-9
Catalog Number:
AG0066AB
Molecular Formula:
C10H9BrO3
Molecular Weight:
257.0807
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
96%
In Stock USA
United States
$75
- +
5g
96%
In Stock USA
United States
$263
- +
10g
96%
In Stock USA
United States
$438
- +
Product Description
Catalog Number:
AG0066AB
Chemical Name:
6-Bromochromane-2-carboxylic acid
CAS Number:
99199-54-9
Molecular Formula:
C10H9BrO3
Molecular Weight:
257.0807
MDL Number:
MFCD07778356
IUPAC Name:
6-bromo-3,4-dihydro-2H-chromene-2-carboxylic acid
InChI:
InChI=1S/C10H9BrO3/c11-7-2-4-8-6(5-7)1-3-9(14-8)10(12)13/h2,4-5,9H,1,3H2,(H,12,13)
InChI Key:
LDOBEICKZURYCC-UHFFFAOYSA-N
SMILES:
OC(=O)C1CCc2c(O1)ccc(c2)Br
Properties
Complexity:
231  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
255.974g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
257.083g/mol
Monoisotopic Mass:
255.974g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
46.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties