Home Halogens Quinoline, 7-bromo-2-methoxy-3-(phenylmethyl)-

Quinoline, 7-bromo-2-methoxy-3-(phenylmethyl)-

CAS No.:
918648-51-8
Catalog Number:
AG006CAU
Molecular Formula:
C17H14BrNO
Molecular Weight:
328.2032
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Product Description
Catalog Number:
AG006CAU
Chemical Name:
Quinoline, 7-bromo-2-methoxy-3-(phenylmethyl)-
CAS Number:
918648-51-8
Molecular Formula:
C17H14BrNO
Molecular Weight:
328.2032
MDL Number:
MFCD28128636
IUPAC Name:
3-benzyl-7-bromo-2-methoxyquinoline
InChI:
InChI=1S/C17H14BrNO/c1-20-17-14(9-12-5-3-2-4-6-12)10-13-7-8-15(18)11-16(13)19-17/h2-8,10-11H,9H2,1H3
InChI Key:
YWOHBUGQXMWRNB-UHFFFAOYSA-N
SMILES:
COc1nc2cc(Br)ccc2cc1Cc1ccccc1
Properties
Complexity:
305  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
327.026g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
328.209g/mol
Monoisotopic Mass:
327.026g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
22.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
5.1  
Properties