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CAT: 0127-BUP11147-03Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0127-BUP11147-03Size:100 mg
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CAS Number
3232-36-8
Purity
=98%
Smiles
Oc1ccccc1\C=N\NC(=O)c1ccccc1O

Chemical Information

Chel 180

2-hydroxy-N'-[(6-oxo-1-cyclohexa-2,4-dienylidene)methyl]benzohydrazide is a member of salicylamides.

CAS Number3232-36-8
PubChem CID135445765
IUPAC Name2-hydroxy-N-[(E)-(2-hydroxyphenyl)methylideneamino]benzamide
Molecular FormulaC14H12N2O3
Molecular Weight256.26
XLogP2.7
Topological Polar Surface Area81.9
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Heavy Atom Count19
Formal Charge0
Complexity333
SMILES
C1=CC=C(C(=C1)/C=N/NC(=O)C2=CC=CC=C2O)O
InChI
InChI=1S/C14H12N2O3/c17-12-7-3-1-5-10(12)9-15-16-14(19)11-6-2-4-8-13(11)18/h1-9,17-18H,(H,16,19)/b15-9+
InChIKey
OMCYEZUIYGPHDJ-OQLLNIDSSA-N
Chemical Structure
2D Structure
2D structure of Chel 180
CAS: 3232-36-8
CID: 135445765
Formula: C14H12N2O3
MW: 256.26
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight256.26
XLogP32.7
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass256.08479225
Monoisotopic Mass256.08479225
Topological Polar Surface Area81.9 Ų
Heavy Atom Count19
Formal Charge0
Complexity333
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count1
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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