Home Other Building Blocks (S)-2-(4-Bromophenyl)-4-t-butyl-4,5-dihydrooxazole

(S)-2-(4-Bromophenyl)-4-t-butyl-4,5-dihydrooxazole

CAS No.:
1305322-94-4
Catalog Number:
AG009WXV
Molecular Formula:
C13H16BrNO
Molecular Weight:
282.1762
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$300
- +
5g
98%
In Stock USA
United States
$1050
- +
Product Description
Catalog Number:
AG009WXV
Chemical Name:
(S)-2-(4-Bromophenyl)-4-t-butyl-4,5-dihydrooxazole
CAS Number:
1305322-94-4
Molecular Formula:
C13H16BrNO
Molecular Weight:
282.1762
MDL Number:
MFCD18914519
IUPAC Name:
(4S)-2-(4-bromophenyl)-4-tert-butyl-4,5-dihydro-1,3-oxazole
InChI:
InChI=1S/C13H16BrNO/c1-13(2,3)11-8-16-12(15-11)9-4-6-10(14)7-5-9/h4-7,11H,8H2,1-3H3/t11-/m1/s1
InChI Key:
JLWQQWPXJJGMSW-LLVKDONJSA-N
SMILES:
CC([C@H]1COC(=N1)c1ccc(cc1)Br)(C)C
Properties
Complexity:
274  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
281.042g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
282.181g/mol
Monoisotopic Mass:
281.042g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
21.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9  
Properties