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2,5-Dichlorobenzhydrazide

CAT: 0127-OR11104-01Size: 1 gDry Ice: NoHazardous: No
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CAT#:0127-OR11104-01Size:1 g
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CAS Number
67487-35-8
MDL Number
MFCD00014754
Purity
97%
Smiles
NNC(=O)C1=C(Cl)C=CC(Cl)=C1

Chemical Information

2,5-Dichlorobenzhydrazide
CAS Number67487-35-8
PubChem CID144246
IUPAC Name2,5-dichlorobenzohydrazide
Molecular FormulaC7H6Cl2N2O
Molecular Weight205.04
XLogP1.8
Topological Polar Surface Area55.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Heavy Atom Count12
Formal Charge0
Complexity177
SMILES
C1=CC(=C(C=C1Cl)C(=O)NN)Cl
InChI
InChI=1S/C7H6Cl2N2O/c8-4-1-2-6(9)5(3-4)7(12)11-10/h1-3H,10H2,(H,11,12)
InChIKey
XECBCXNWGBDIMG-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 2,5-Dichlorobenzhydrazide
CAS: 67487-35-8
CID: 144246
Formula: C7H6Cl2N2O
MW: 205.04
Interactive 3D Structure
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Computed Properties
PropertyValue
Molecular Weight205.04
XLogP31.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count2
Rotatable Bond Count1
Exact Mass203.9857182
Monoisotopic Mass203.9857182
Topological Polar Surface Area55.1 Ų
Heavy Atom Count12
Formal Charge0
Complexity177
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