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Home > Quinoline > 100926-75-8
100926-75-8 | Carbamic acid, (2-methoxyphenyl)-, 6-quinolinyl ester (9CI)
CAS No: 100926-75-8 Catalog No: AG000377 MDL No:
Product Description
Catalog Number:
AG000377
Chemical Name:
Carbamic acid, (2-methoxyphenyl)-, 6-quinolinyl ester (9CI)
CAS Number:
100926-75-8
Molecular Formula:
C17H14N2O3
Molecular Weight:
294.3047
IUPAC Name:
quinolin-6-yl N-(2-methoxyphenyl)carbamate
InChI:
InChI=1S/C17H14N2O3/c1-21-16-7-3-2-6-15(16)19-17(20)22-13-8-9-14-12(11-13)5-4-10-18-14/h2-11H,1H3,(H,19,20)
InChI Key:
DSEHCRCHAIWKOU-UHFFFAOYSA-N
SMILES:
COc1ccccc1NC(=O)Oc1ccc2c(c1)cccn2
Properties
Complexity:
377
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
294.1g/mol
Formal Charge:
0
Heavy Atom Count:
22
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
294.31g/mol
Monoisotopic Mass:
294.1g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
60.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.3
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