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932710-56-0 | Valeraldehyde-O-pentafluorophenylmethyl-oxime
CAS No: 932710-56-0 Catalog No: AG0064LN MDL No:
Product Description
Catalog Number:
AG0064LN
Chemical Name:
Valeraldehyde-O-pentafluorophenylmethyl-oxime
CAS Number:
932710-56-0
Molecular Formula:
C12H12F5NO
Molecular Weight:
281.2218
IUPAC Name:
N-[(2,3,4,5,6-pentafluorophenyl)methoxy]pentan-1-imine
InChI:
InChI=1S/C12H12F5NO/c1-2-3-4-5-18-19-6-7-8(13)10(15)12(17)11(16)9(7)14/h5H,2-4,6H2,1H3
InChI Key:
CQVUQQBKUBLHIZ-UHFFFAOYSA-N
SMILES:
CCCC/C=N/OCc1c(F)c(F)c(c(c1F)F)F
Properties
Complexity:
275
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
281.084g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
7
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
281.226g/mol
Monoisotopic Mass:
281.084g/mol
Rotatable Bond Count:
6
Topological Polar Surface Area:
21.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
3.7
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