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86357-99-5 | Acetic acid, [[[(2,6-dichlorophenyl)methylene]amino]oxy]-
CAS No: 86357-99-5 Catalog No: AG004IUF MDL No:
Product Description
Catalog Number:
AG004IUF
Chemical Name:
Acetic acid, [[[(2,6-dichlorophenyl)methylene]amino]oxy]-
CAS Number:
86357-99-5
Molecular Formula:
C9H7Cl2NO3
Molecular Weight:
248.0628
IUPAC Name:
2-[(2,6-dichlorophenyl)methylideneamino]oxyacetic acid
InChI:
InChI=1S/C9H7Cl2NO3/c10-7-2-1-3-8(11)6(7)4-12-15-5-9(13)14/h1-4H,5H2,(H,13,14)
InChI Key:
AYKFRMVKIMORGN-UHFFFAOYSA-N
SMILES:
OC(=O)CON=Cc1c(Cl)cccc1Cl
Properties
Complexity:
238
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
246.98g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
248.059g/mol
Monoisotopic Mass:
246.98g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
58.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
1
XLogP3:
2.8
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