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3-Methoxy-2-methylbenzhydrazide

CAT: 0127-OR303093Size: 1 EachDry Ice: NoHazardous: No
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CAS Number
740799-69-3
Synonyms
3-Methoxy-2-methylbenzohydrazide
MDL Number
MFCD12031987
Purity
=95%
Smiles
COc1cccc(C(=O)NN)c1C

Chemical Information

3-Methoxy-2-methylbenzohydrazide
CAS Number740799-69-3
PubChem CID45091273
IUPAC Name3-methoxy-2-methylbenzohydrazide
Molecular FormulaC9H12N2O2
Molecular Weight180.20
XLogP0.8
Topological Polar Surface Area64.4
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count13
Formal Charge0
Complexity184
SMILES
CC1=C(C=CC=C1OC)C(=O)NN
InChI
InChI=1S/C9H12N2O2/c1-6-7(9(12)11-10)4-3-5-8(6)13-2/h3-5H,10H2,1-2H3,(H,11,12)
InChIKey
WWFFBSDIHURYFK-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 3-Methoxy-2-methylbenzohydrazide
CAS: 740799-69-3
CID: 45091273
Formula: C9H12N2O2
MW: 180.20
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight180.20
XLogP30.8
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass180.089877630
Monoisotopic Mass180.089877630
Topological Polar Surface Area64.4 Ų
Heavy Atom Count13
Formal Charge0
Complexity184
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

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