1-(1,5-Dimethyl-1H-pyrazol-4-yl)ethanone oxime - CAS 1019067-48-1
Catalog: |
BB051740 |
Product Name: |
1-(1,5-Dimethyl-1H-pyrazol-4-yl)ethanone oxime |
CAS: |
1019067-48-1 |
Synonyms: |
N-[1-(1,5-dimethyl-1H-pyrazol-4-yl)ethylidene]hydroxylamine |
IUPAC Name: | (NE)-N-[1-(1,5-dimethylpyrazol-4-yl)ethylidene]hydroxylamine |
Molecular Weight: | 153.18 |
Molecular Formula: | C7H11N3O |
Canonical SMILES: | CC1=C(C=NN1C)C(=NO)C |
InChI: | InChI=1S/C7H11N3O/c1-5(9-11)7-4-8-10(3)6(7)2/h4,11H,1-3H3/b9-5+ |
InChI Key: | QESYGHRTVFHGAW-WEVVVXLNSA-N |
Complexity: | 169 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 1 |
Exact Mass: | 153.090211983 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 3 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 153.090211983 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 50.4 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.6 |
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