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Home Other Building Blocks 5-Bromo-2-tert-butyl-3-hydroxyisoindolin-1-one

5-Bromo-2-tert-butyl-3-hydroxyisoindolin-1-one

CAS No.:
1245563-22-7
Catalog Number:
AG000M7E
Molecular Formula:
C12H14BrNO2
Molecular Weight:
284.1491
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
In Stock USA
United States
$75
- +
5g
95%
In Stock USA
United States
$225
- +
25g
95%
In Stock USA
United States
$600
- +
Product Description
Catalog Number:
AG000M7E
Chemical Name:
5-Bromo-2-tert-butyl-3-hydroxyisoindolin-1-one
CAS Number:
1245563-22-7
Molecular Formula:
C12H14BrNO2
Molecular Weight:
284.1491
MDL Number:
MFCD17015788
IUPAC Name:
5-bromo-2-tert-butyl-3-hydroxy-3H-isoindol-1-one
InChI:
InChI=1S/C12H14BrNO2/c1-12(2,3)14-10(15)8-5-4-7(13)6-9(8)11(14)16/h4-6,11,16H,1-3H3
InChI Key:
VAUUWFDGCFIPDZ-UHFFFAOYSA-N
SMILES:
Brc1ccc2c(c1)C(O)N(C2=O)C(C)(C)C
Properties
Complexity:
300  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
283.021g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
284.153g/mol
Monoisotopic Mass:
283.021g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
40.5A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1  
Properties