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1016315-12-0 | Quinoline, 2-chloro-5-(phenylmethoxy)-
CAS No: 1016315-12-0 Catalog No: AG00050E MDL No:MFCD20482427
Product Description
Catalog Number:
AG00050E
Chemical Name:
Quinoline, 2-chloro-5-(phenylmethoxy)-
CAS Number:
1016315-12-0
Molecular Formula:
C16H12ClNO
Molecular Weight:
269.7256
MDL Number:
MFCD20482427
IUPAC Name:
2-chloro-5-phenylmethoxyquinoline
InChI:
InChI=1S/C16H12ClNO/c17-16-10-9-13-14(18-16)7-4-8-15(13)19-11-12-5-2-1-3-6-12/h1-10H,11H2
InChI Key:
HITLHUWQHZDRMQ-UHFFFAOYSA-N
SMILES:
Clc1ccc2c(n1)cccc2OCc1ccccc1
Properties
Complexity:
280
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
269.061g/mol
Formal Charge:
0
Heavy Atom Count:
19
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
269.728g/mol
Monoisotopic Mass:
269.061g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
22.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.6
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