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3-[ (2,3-Dichlorophenoxy) methyl]-4-methoxybenzohydrazide

CAT: 0926-NSA21858-01Size: 250 mgDry Ice: NoHazardous: No
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CAT#:0926-NSA21858-01Size:250 mg
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CAS Number
438218-58-7
MDL Number
MFCD03419445
Smiles
COC1=C (C=C (C=C1) C (=O) NN) COC2=C (C (=CC=C2) Cl) Cl
Molecular Formula
C15H14Cl2N2O3
Molecular Weight
341.2 g/mol
Controlled
No

Chemical Information

3-[(2,3-Dichlorophenoxy)methyl]-4-methoxybenzohydrazide
CAS Number438218-58-7
PubChem CID843268
IUPAC Name3-[(2,3-dichlorophenoxy)methyl]-4-methoxybenzohydrazide
Molecular FormulaC15H14Cl2N2O3
Molecular Weight341.2
XLogP3.1
Topological Polar Surface Area73.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count22
Formal Charge0
Complexity373
SMILES
COC1=C(C=C(C=C1)C(=O)NN)COC2=C(C(=CC=C2)Cl)Cl
InChI
InChI=1S/C15H14Cl2N2O3/c1-21-12-6-5-9(15(20)19-18)7-10(12)8-22-13-4-2-3-11(16)14(13)17/h2-7H,8,18H2,1H3,(H,19,20)
InChIKey
FERLJSXKGQPYMN-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-[(2,3-Dichlorophenoxy)methyl]-4-methoxybenzohydrazide
CAS: 438218-58-7
CID: 843268
Formula: C15H14Cl2N2O3
MW: 341.2
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight341.2
XLogP33.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass340.0381477
Monoisotopic Mass340.0381477
Topological Polar Surface Area73.6 Ų
Heavy Atom Count22
Formal Charge0
Complexity373
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