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40335-00-0 | 2,4-dimethoxyquinoline
CAS No: 40335-00-0 Catalog No: AG00378R MDL No:MFCD27950422
Product Description
Catalog Number:
AG00378R
Chemical Name:
2,4-dimethoxyquinoline
CAS Number:
40335-00-0
Molecular Formula:
C11H11NO2
Molecular Weight:
189.2105
MDL Number:
MFCD27950422
IUPAC Name:
2,4-dimethoxyquinoline
InChI:
InChI=1S/C11H11NO2/c1-13-10-7-11(14-2)12-9-6-4-3-5-8(9)10/h3-7H,1-2H3
InChI Key:
XSZBLRGKCBUWRJ-UHFFFAOYSA-N
SMILES:
COc1cc(OC)nc2c1cccc2
NSC Number:
298324
Properties
Complexity:
186
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
189.079g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
189.214g/mol
Monoisotopic Mass:
189.079g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
31.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.5
Literature
| Title | Journal |
|---|---|
| Demethylation of 2,4-dimethoxyquinolines: the synthesis of atanine. | Organic & biomolecular chemistry 20031221 |
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