Home Other Building Blocks 3-Bromo-5-phenyl-4,5-dihydroisoxazole

3-Bromo-5-phenyl-4,5-dihydroisoxazole

CAS No.:
86256-88-4
Catalog Number:
AG004S20
Molecular Formula:
C9H8BrNO
Molecular Weight:
226.0699
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
95%
In Stock USA
United States
$150
- +
1g
95%
In Stock USA
United States
$350
- +
5g
95%
In Stock USA
United States
$1125
- +
Product Description
Catalog Number:
AG004S20
Chemical Name:
3-Bromo-5-phenyl-4,5-dihydroisoxazole
CAS Number:
86256-88-4
Molecular Formula:
C9H8BrNO
Molecular Weight:
226.0699
MDL Number:
MFCD11707003
IUPAC Name:
3-bromo-5-phenyl-4,5-dihydro-1,2-oxazole
InChI:
InChI=1S/C9H8BrNO/c10-9-6-8(12-11-9)7-4-2-1-3-5-7/h1-5,8H,6H2
InChI Key:
LNXKJBBQEFYTQV-UHFFFAOYSA-N
SMILES:
BrC1=NOC(C1)c1ccccc1
Properties
Complexity:
187  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
224.979g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
226.073g/mol
Monoisotopic Mass:
224.979g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
21.6A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5  
Properties