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Home > Quinoline > 115581-03-8
115581-03-8 | Carbamic acid, N,N-dimethyl-, 7-quinolinyl ester
CAS No: 115581-03-8 Catalog No: AG000G7I MDL No:
Product Description
Catalog Number:
AG000G7I
Chemical Name:
Carbamic acid, N,N-dimethyl-, 7-quinolinyl ester
CAS Number:
115581-03-8
Molecular Formula:
C12H12N2O2
Molecular Weight:
216.2359
IUPAC Name:
quinolin-7-yl N,N-dimethylcarbamate
InChI:
InChI=1S/C12H12N2O2/c1-14(2)12(15)16-10-6-5-9-4-3-7-13-11(9)8-10/h3-8H,1-2H3
InChI Key:
IOGBSPBEMWFBFB-UHFFFAOYSA-N
SMILES:
O=C(N(C)C)Oc1ccc2c(c1)nccc2
Properties
Complexity:
255
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.09g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
216.24g/mol
Monoisotopic Mass:
216.09g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
42.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2
Literature
| Title | Journal |
|---|---|
| Harnessing anionic rearrangements on the benzenoid ring of quinoline for the synthesis of 6,6'-disubstituted 7,7'-dihydroxy-8,8'-biquinolyls. | The Journal of organic chemistry 20050107 |
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