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Home > Quinoline > 1306604-29-4
1306604-29-4 | tert-butyl N-[4-(quinolin-4-yloxy)phenyl]carbamate
CAS No: 1306604-29-4 Catalog No: AG01AIJW MDL No:MFCD18839130
Product Description
Catalog Number:
AG01AIJW
Chemical Name:
tert-butyl N-[4-(quinolin-4-yloxy)phenyl]carbamate
CAS Number:
1306604-29-4
Molecular Formula:
C20H20N2O3
Molecular Weight:
336.3844
MDL Number:
MFCD18839130
IUPAC Name:
tert-butyl N-(4-quinolin-4-yloxyphenyl)carbamate
InChI:
InChI=1S/C20H20N2O3/c1-20(2,3)25-19(23)22-14-8-10-15(11-9-14)24-18-12-13-21-17-7-5-4-6-16(17)18/h4-13H,1-3H3,(H,22,23)
InChI Key:
MJQSYBLHBFKKQJ-UHFFFAOYSA-N
SMILES:
O=C(OC(C)(C)C)Nc1ccc(cc1)Oc1ccnc2c1cccc2
Properties
Complexity:
441
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
336.147g/mol
Formal Charge:
0
Heavy Atom Count:
25
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
336.391g/mol
Monoisotopic Mass:
336.147g/mol
Rotatable Bond Count:
5
Topological Polar Surface Area:
60.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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