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23964-38-7 | Benzoic acid,4-ethoxy-3,5-diiodo-, hydrazide
CAS No: 23964-38-7 Catalog No: AG007ODE MDL No:
Product Description
Catalog Number:
AG007ODE
Chemical Name:
Benzoic acid,4-ethoxy-3,5-diiodo-, hydrazide
CAS Number:
23964-38-7
Molecular Formula:
C9H10I2N2O2
Molecular Weight:
431.9968
IUPAC Name:
4-ethoxy-3,5-diiodobenzohydrazide
InChI:
InChI=1S/C9H10I2N2O2/c1-2-15-8-6(10)3-5(4-7(8)11)9(14)13-12/h3-4H,2,12H2,1H3,(H,13,14)
InChI Key:
NCKSIHZXONNRPT-UHFFFAOYSA-N
SMILES:
CCOc1c(I)cc(cc1I)C(=O)NN
Properties
Complexity:
216
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
431.883g/mol
Formal Charge:
0
Heavy Atom Count:
15
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
432g/mol
Monoisotopic Mass:
431.883g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
64.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.1
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