Home Other Building Blocks (S)-4-tert-Butyl-2-(5-(trifluoromethyl)pyridin-2-yl)-4,5-dihydrooxazole

(S)-4-tert-Butyl-2-(5-(trifluoromethyl)pyridin-2-yl)-4,5-dihydrooxazole

CAS No.:
1416819-91-4
Catalog Number:
AG001GVK
Molecular Formula:
C13H15F3N2O
Molecular Weight:
272.2662
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
96%
In Stock USA
United States
$150
- +
1g
96%
In Stock USA
United States
$400
- +
5g
96%
In Stock USA
United States
$1200
- +
Product Description
Catalog Number:
AG001GVK
Chemical Name:
(S)-4-tert-Butyl-2-(5-(trifluoromethyl)pyridin-2-yl)-4,5-dihydrooxazole
CAS Number:
1416819-91-4
Molecular Formula:
C13H15F3N2O
Molecular Weight:
272.2662
MDL Number:
MFCD23701103
IUPAC Name:
(4S)-4-tert-butyl-2-[5-(trifluoromethyl)pyridin-2-yl]-4,5-dihydro-1,3-oxazole
InChI:
InChI=1S/C13H15F3N2O/c1-12(2,3)10-7-19-11(18-10)9-5-4-8(6-17-9)13(14,15)16/h4-6,10H,7H2,1-3H3/t10-/m1/s1
InChI Key:
AATATIAROAAKIN-SNVBAGLBSA-N
SMILES:
CC([C@H]1COC(=N1)c1ccc(cn1)C(F)(F)F)(C)C
Properties
Complexity:
360  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
272.114g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
272.271g/mol
Monoisotopic Mass:
272.114g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
34.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties