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544418-04-4

544418-04-4 | 1-(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-Heptadecafluoroundecyl)-3,1-benzoxazine-2,4(1H)-dione

CAS No: 544418-04-4 Catalog No: AG003CY0 MDL No:

Product Description

Catalog Number:
AG003CY0
Chemical Name:
1-(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-Heptadecafluoroundecyl)-3,1-benzoxazine-2,4(1H)-dione
CAS Number:
544418-04-4
IUPAC Name:
1-(4,4,5,5,6,6,7,7,8,8,9,9,10,10,11,11,11-heptadecafluoroundecyl)-3,1-benzoxazine-2,4-dione
InChI:
InChI=1S/C19H10F17NO3/c20-12(21,6-3-7-37-9-5-2-1-4-8(9)10(38)40-11(37)39)13(22,23)14(24,25)15(26,27)16(28,29)17(30,31)18(32,33)19(34,35)36/h1-2,4-5H,3,6-7H2
InChI Key:
JRKNOQQQWMFWME-UHFFFAOYSA-N

Properties

Complexity:
978  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
623.039g/mol
Formal Charge:
0
Heavy Atom Count:
40  
Hydrogen Bond Acceptor Count:
20  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
623.266g/mol
Monoisotopic Mass:
623.039g/mol
Rotatable Bond Count:
10  
Topological Polar Surface Area:
46.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
7.7  

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