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144770-79-6

144770-79-6 | Benzamide, N-(2-hydroxyethyl)-4-[(undecafluorohexenyl)oxy]- (9CI)

CAS No: 144770-79-6 Catalog No: AG001K56 MDL No:

Product Description

Catalog Number:
AG001K56
Chemical Name:
Benzamide, N-(2-hydroxyethyl)-4-[(undecafluorohexenyl)oxy]- (9CI)
CAS Number:
144770-79-6
Molecular Formula:
C15H10F11NO3
Molecular Weight:
461.2272
IUPAC Name:
N-(2-hydroxyethyl)-4-(1,2,3,3,4,4,5,5,6,6,6-undecafluorohex-1-enoxy)benzamide
InChI:
InChI=1S/C15H10F11NO3/c16-9(12(18,19)13(20,21)14(22,23)15(24,25)26)10(17)30-8-3-1-7(2-4-8)11(29)27-5-6-28/h1-4,28H,5-6H2,(H,27,29)
InChI Key:
VZUSXFPXFFDPKO-UHFFFAOYSA-N
SMILES:
OCCNC(=O)c1ccc(cc1)OC(=C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)F)F

Properties

Complexity:
640  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
461.049g/mol
Formal Charge:
0
Heavy Atom Count:
30  
Hydrogen Bond Acceptor Count:
14  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
461.231g/mol
Monoisotopic Mass:
461.049g/mol
Rotatable Bond Count:
8  
Topological Polar Surface Area:
58.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1  
XLogP3:
3.9  

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