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829666-49-1 | Carbamic acid, diethyl-, 7-quinolinyl ester
CAS No: 829666-49-1 Catalog No: AG0053TV MDL No:
Product Description
Catalog Number:
AG0053TV
Chemical Name:
Carbamic acid, diethyl-, 7-quinolinyl ester
CAS Number:
829666-49-1
Molecular Formula:
C14H16N2O2
Molecular Weight:
244.2890
IUPAC Name:
quinolin-7-yl N,N-diethylcarbamate
InChI:
InChI=1S/C14H16N2O2/c1-3-16(4-2)14(17)18-12-8-7-11-6-5-9-15-13(11)10-12/h5-10H,3-4H2,1-2H3
InChI Key:
UBMMLTWYBARHRK-UHFFFAOYSA-N
SMILES:
CCN(C(=O)Oc1ccc2c(c1)nccc2)CC
Properties
Complexity:
279
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.121g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
244.294g/mol
Monoisotopic Mass:
244.121g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
42.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.9
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