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209736-53-8

209736-53-8 | 2H-1-Benzopyran-2-one, 5,6,7,8-tetrafluoro-4-hydroxy-3-(1-iminoethyl)-

CAS No: 209736-53-8 Catalog No: AG002KE9 MDL No:

Product Description

Catalog Number:
AG002KE9
Chemical Name:
2H-1-Benzopyran-2-one, 5,6,7,8-tetrafluoro-4-hydroxy-3-(1-iminoethyl)-
CAS Number:
209736-53-8
Molecular Formula:
C11H5F4NO3
Molecular Weight:
275.1559
IUPAC Name:
3-ethanimidoyl-5,6,7,8-tetrafluoro-4-hydroxychromen-2-one
InChI:
InChI=1S/C11H5F4NO3/c1-2(16)3-9(17)4-5(12)6(13)7(14)8(15)10(4)19-11(3)18/h16-17H,1H3
InChI Key:
IHURFSSAEATOAQ-UHFFFAOYSA-N
SMILES:
Fc1c(F)c(F)c2c(c1F)c(O)c(c(=O)o2)C(=N)C

Properties

Complexity:
467  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
275.021g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
275.159g/mol
Monoisotopic Mass:
275.021g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
70.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  

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