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101913-93-3

101913-93-3 | 4-Heptanone, 1,7-dichloro-1,1,7,7-tetrafluoro-2,6-dihydroxy-2,6-bis(trifluoromethyl)-, hydrazone

CAS No: 101913-93-3 Catalog No: AG0005YL MDL No:

Product Description

Catalog Number:
AG0005YL
Chemical Name:
4-Heptanone, 1,7-dichloro-1,1,7,7-tetrafluoro-2,6-dihydroxy-2,6-bis(trifluoromethyl)-, hydrazone
CAS Number:
101913-93-3
Molecular Formula:
C9H8Cl2F10N2O2
Molecular Weight:
437.0621
IUPAC Name:
1-chloro-6-[chloro(difluoro)methyl]-1,1,7,7,7-pentafluoro-4-hydrazinylidene-2-(trifluoromethyl)heptane-2,6-diol
InChI:
InChI=1S/C9H8Cl2F10N2O2/c10-6(12,13)4(24,8(16,17)18)1-3(23-22)2-5(25,7(11,14)15)9(19,20)21/h24-25H,1-2,22H2
InChI Key:
LGMUJSLDWXUYRS-UHFFFAOYSA-N
SMILES:
NN=C(CC(C(Cl)(F)F)(C(F)(F)F)O)CC(C(Cl)(F)F)(C(F)(F)F)O

Properties

Complexity:
482  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
435.98g/mol
Formal Charge:
0
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
14  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
437.059g/mol
Monoisotopic Mass:
435.98g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
78.8A^2
Undefined Atom Stereocenter Count:
2  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.1  

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