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Home > Quinoline > 500350-48-1
500350-48-1 | 2,5,8-trimethylquinolin-4-ol
CAS No: 500350-48-1 Catalog No: AG006WDL MDL No:MFCD05743585
Product Description
Catalog Number:
AG006WDL
Chemical Name:
2,5,8-trimethylquinolin-4-ol
CAS Number:
500350-48-1
Molecular Formula:
C12H13NO
Molecular Weight:
187.2377
MDL Number:
MFCD05743585
IUPAC Name:
2,5,8-trimethyl-1H-quinolin-4-one
InChI:
InChI=1S/C12H13NO/c1-7-4-5-8(2)12-11(7)10(14)6-9(3)13-12/h4-6H,1-3H3,(H,13,14)
InChI Key:
JTVSWQVZPILKJO-UHFFFAOYSA-N
SMILES:
Cc1cc(O)c2c(n1)c(C)ccc2C
NSC Number:
109813
Properties
Complexity:
282
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
187.1g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
187.242g/mol
Monoisotopic Mass:
187.1g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
29.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7
Literature
| Title | Journal |
|---|---|
| Microsphere-based protease assays and screening application for lethal factor and factor Xa. | Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501 |
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