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72107-05-2 | 2,2,4-Trimethyl-1,2-dihydroquinolin-6-ol
CAS No: 72107-05-2 Catalog No: AG005WJ4 MDL No:MFCD00193033
Product Description
Catalog Number:
AG005WJ4
Chemical Name:
2,2,4-Trimethyl-1,2-dihydroquinolin-6-ol
CAS Number:
72107-05-2
Molecular Formula:
C12H15NO
Molecular Weight:
189.2536
MDL Number:
MFCD00193033
IUPAC Name:
2,2,4-trimethyl-1H-quinolin-6-ol
InChI:
InChI=1S/C12H15NO/c1-8-7-12(2,3)13-11-5-4-9(14)6-10(8)11/h4-7,13-14H,1-3H3
InChI Key:
QSINDHMECZQCAW-UHFFFAOYSA-N
SMILES:
Oc1ccc2c(c1)C(=CC(N2)(C)C)C
Properties
Complexity:
257
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.115g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
189.258g/mol
Monoisotopic Mass:
189.115g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
32.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4
Literature
| Title | Journal |
|---|---|
| Antitrypanosomal activity of 1,2-dihydroquinolin-6-ols and their ester derivatives. | Journal of medicinal chemistry 20100211 |
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