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202259-06-1 | Quinoline, 5-broMo-8-(phenylMethoxy)-
CAS No: 202259-06-1 Catalog No: AG00285A MDL No:MFCD03827565
Product Description
Catalog Number:
AG00285A
Chemical Name:
Quinoline, 5-broMo-8-(phenylMethoxy)-
CAS Number:
202259-06-1
Molecular Formula:
C16H12BrNO
Molecular Weight:
314.1766
MDL Number:
MFCD03827565
IUPAC Name:
5-bromo-8-phenylmethoxyquinoline
InChI:
InChI=1S/C16H12BrNO/c17-14-8-9-15(16-13(14)7-4-10-18-16)19-11-12-5-2-1-3-6-12/h1-10H,11H2
InChI Key:
LZYYBSWLPXPHAO-UHFFFAOYSA-N
SMILES:
Brc1ccc(c2c1cccn2)OCc1ccccc1
Properties
Complexity:
280
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
313.01g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
314.182g/mol
Monoisotopic Mass:
313.01g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
22.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.2
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