8-Isopropylquinoline N-oxide - CAS 1246242-17-0
Catalog: |
BB005952 |
Product Name: |
8-Isopropylquinoline N-oxide |
CAS: |
1246242-17-0 |
Synonyms: |
1-oxido-8-propan-2-ylquinolin-1-ium |
IUPAC Name: | 1-oxido-8-propan-2-ylquinolin-1-ium |
Description: | 8-Isopropylquinoline N-oxide (CAS# 1246242-17-0 ) is a useful research chemical. |
Molecular Weight: | 187.24 |
Molecular Formula: | C12H13NO |
Canonical SMILES: | CC(C)C1=CC=CC2=C1[N+](=CC=C2)[O-] |
InChI: | InChI=1S/C12H13NO/c1-9(2)11-7-3-5-10-6-4-8-13(14)12(10)11/h3-9H,1-2H3 |
InChI Key: | LYLSTLGFFOQSKE-UHFFFAOYSA-N |
LogP: | 3.39170 |
Complexity: | 193 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 187.099714038 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 1 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 187.099714038 |
Rotatable Bond Count: | 1 |
Topological Polar Surface Area: | 25.5 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.3 |
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Related Functional Groups
Quinoline/Isoquinoline
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