1-Butyl-4-methylquinolin-2(1H)-one - CAS 32511-84-5
Catalog: |
BB021317 |
Product Name: |
1-Butyl-4-methylquinolin-2(1H)-one |
CAS: |
32511-84-5 |
Synonyms: |
1-butyl-4-methyl-2-quinolinone; 1-butyl-4-methylquinolin-2-one |
IUPAC Name: | 1-butyl-4-methylquinolin-2-one |
Description: | 1-Butyl-4-methylquinolin-2(1H)-one (CAS# 32511-84-5 ) is a useful research chemical. |
Molecular Weight: | 215.29 |
Molecular Formula: | C14H17NO |
Canonical SMILES: | CCCCN1C2=CC=CC=C2C(=CC1=O)C |
InChI: | InChI=1S/C14H17NO/c1-3-4-9-15-13-8-6-5-7-12(13)11(2)10-14(15)16/h5-8,10H,3-4,9H2,1-2H3 |
InChI Key: | BDQRFECVDXBVMM-UHFFFAOYSA-N |
Boiling Point: | 310.7 °C at 760 mmHg |
Density: | 1.046 g/cm3 |
LogP: | 3.11000 |
Publication Number | Title | Priority Date |
CN-112979606-A | Organic boric acid catalyzed CO2Preparation of cyclic carbonate | 20191202 |
CN-108864075-B | Isothiazole bithiazole derivative and preparation method and application thereof | 20180726 |
CN-107216282-B | α -amino acrylic acid microbicide and preparation method and application thereof | 20170516 |
CN-111362933-A | α -amino acrylic acid microbicide and preparation method and application thereof | 20170516 |
WO-2017129113-A1 | Bromohexahydroindanone compounds, preparation method for same, and uses thereof | 20160129 |
Complexity: | 295 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 215.131014166 |
Formal Charge: | 0 |
Heavy Atom Count: | 16 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 215.131014166 |
Rotatable Bond Count: | 3 |
Topological Polar Surface Area: | 20.3 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.7 |
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