Rifabutin EP Impurity A - CAS 72544-16-2
Catalog: |
BB034648 |
Product Name: |
Rifabutin EP Impurity A |
CAS: |
72544-16-2 |
Synonyms: |
1-Isobutyl-4-piperidone; 1-Isobutyl-4-piperidone; 1-(2-Methylpropyl)-4-piperidone |
IUPAC Name: | 1-(2-methylpropyl)piperidin-4-one |
Description: | An impurity of Rifabutin. Rifabutin is an antibiotic used to treat tuberculosis and prevent and treat Mycobacterium avium complex. |
Molecular Weight: | 155.24 |
Molecular Formula: | C9H17NO |
Canonical SMILES: | CC(C)CN1CCC(=O)CC1 |
InChI: | InChI=1S/C9H17NO/c1-8(2)7-10-5-3-9(11)4-6-10/h8H,3-7H2,1-2H3 |
InChI Key: | KMTASGXMTBUSSP-UHFFFAOYSA-N |
Boiling Point: | 220 °C |
Purity: | 98.0 % |
Density: | 0.914 g/cm3 |
Appearance: | Colorless to yellow liquid |
MDL: | MFCD00190595 |
LogP: | 1.24520 |
GHS Hazard Statement: | H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral] |
Precautionary Statement: | P264, P270, P280, P301+P312, P302+P352, P305+P351+P338, P321, P330, P332+P313, P337+P313, P362, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
JP-2021046434-A | A new method for producing a perfluoroalkylating agent using monohydroperfluoroalkane as a starting material, and a method for producing an aromatic perfluoroalkyl compound using them. | 20201207 |
JP-2021054833-A | A new method for producing a perfluoroalkylating agent using monohydroperfluoroalkane as a starting material, and a method for producing an aromatic perfluoroalkyl compound using them. | 20201207 |
JP-2021054834-A | A new method for producing a perfluoroalkylating agent using monohydroperfluoroalkane as a starting material, and a method for producing an aromatic perfluoroalkyl compound using them. | 20201207 |
US-2021144998-A1 | Compositions and methods for treating huanglongbing disease in citrus | 20191115 |
BR-112020012002-A2 | diazaindole compounds | 20171220 |
Complexity: | 133 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 155.131014166 |
Formal Charge: | 0 |
Heavy Atom Count: | 11 |
Hydrogen Bond Acceptor Count: | 2 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 155.131014166 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 20.3 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 1 |
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