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2'-Hydroxychalcone hydrazone

CAT: 0926-FH66241-01Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0926-FH66241-01Size:100 mg
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CAS Number
4590-70-9
MDL Number
MFCD00017085
Smiles
N\N=C (/C=C/c1ccccc1) \c2ccccc2O
Molecular Formula
C15H14N2O
Molecular Weight
238.28 g/mol
Controlled
No

Chemical Information

2'-Hydroxychalcone hydrazone
CAS Number4590-70-9
PubChem CID135893381
IUPAC Name2-[(E)-3-phenylprop-2-enehydrazonoyl]phenol
Molecular FormulaC15H14N2O
Molecular Weight238.28
XLogP3.3
Topological Polar Surface Area58.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Heavy Atom Count18
Formal Charge0
Complexity306
SMILES
C1=CC=C(C=C1)/C=C/C(=N\N)/C2=CC=CC=C2O
InChI
InChI=1S/C15H14N2O/c16-17-14(13-8-4-5-9-15(13)18)11-10-12-6-2-1-3-7-12/h1-11,18H,16H2/b11-10+,17-14+
InChIKey
AVMGXXCTNFBLOD-PKAMWHFSSA-N
Chemical Structure
2D Structure
2D structure of 2'-Hydroxychalcone hydrazone
CAS: 4590-70-9
CID: 135893381
Formula: C15H14N2O
MW: 238.28
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight238.28
XLogP33.3
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass238.110613074
Monoisotopic Mass238.110613074
Topological Polar Surface Area58.6 Ų
Heavy Atom Count18
Formal Charge0
Complexity306
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count2
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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