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4-Iodobenzenesulfonohydrazide

CAT: 0127-OR1038265-01Size: 250 mgDry Ice: NoHazardous: No
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CAT#:0127-OR1038265-01Size:250 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
2751-27-1
MDL Number
MFCD00159283
Purity
95%
Smiles
C1=C(C=CC(=C1)S(=O)(=O)NN)I

Chemical Information

4-Iodobenzenesulfonic acid hydrazide
CAS Number2751-27-1
PubChem CID4247643
IUPAC Name4-iodobenzenesulfonohydrazide
Molecular FormulaC6H7IN2O2S
Molecular Weight298.10
XLogP0.5
Topological Polar Surface Area80.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Heavy Atom Count12
Formal Charge0
Complexity228
SMILES
C1=CC(=CC=C1S(=O)(=O)NN)I
InChI
InChI=1S/C6H7IN2O2S/c7-5-1-3-6(4-2-5)12(10,11)9-8/h1-4,9H,8H2
InChIKey
IAXWCGDMDZJFHA-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 4-Iodobenzenesulfonic acid hydrazide
CAS: 2751-27-1
CID: 4247643
Formula: C6H7IN2O2S
MW: 298.10
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight298.10
XLogP30.5
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count2
Exact Mass297.92730
Monoisotopic Mass297.92730
Topological Polar Surface Area80.6 Ų
Heavy Atom Count12
Formal Charge0
Complexity228
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes