Home Other Building Blocks (S)-tert-butyl 1-(4-(trifluoromethoxy)phenyl)ethylcarbamate

(S)-tert-butyl 1-(4-(trifluoromethoxy)phenyl)ethylcarbamate

CAS No.:
1391394-94-7
Catalog Number:
AG01D8TR
Molecular Formula:
C14H18F3NO3
Molecular Weight:
305.2928
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Product Description
Catalog Number:
AG01D8TR
Chemical Name:
(S)-tert-butyl 1-(4-(trifluoromethoxy)phenyl)ethylcarbamate
CAS Number:
1391394-94-7
Molecular Formula:
C14H18F3NO3
Molecular Weight:
305.2928
MDL Number:
MFCD19443235
IUPAC Name:
tert-butyl N-[(1S)-1-[4-(trifluoromethoxy)phenyl]ethyl]carbamate
InChI:
InChI=1S/C14H18F3NO3/c1-9(18-12(19)21-13(2,3)4)10-5-7-11(8-6-10)20-14(15,16)17/h5-9H,1-4H3,(H,18,19)/t9-/m0/s1
InChI Key:
CYXYDKSECKOTHS-VIFPVBQESA-N
SMILES:
O=C(OC(C)(C)C)N[C@H](c1ccc(cc1)OC(F)(F)F)C
Properties
Complexity:
344  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
305.124g/mol
Formal Charge:
0
Heavy Atom Count:
21  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
305.297g/mol
Monoisotopic Mass:
305.124g/mol
Rotatable Bond Count:
5  
Topological Polar Surface Area:
47.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4  
Properties