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79615-80-8 | 1-(2-((4-Chlorobenzyl)oxy)phenyl)ethanone
CAS No: 79615-80-8 Catalog No: AG0057M1 MDL No:MFCD03001268
Product Description
Catalog Number:
AG0057M1
Chemical Name:
1-(2-((4-Chlorobenzyl)oxy)phenyl)ethanone
CAS Number:
79615-80-8
Molecular Formula:
C15H13ClO2
Molecular Weight:
260.7155
MDL Number:
MFCD03001268
IUPAC Name:
1-[2-[(4-chlorophenyl)methoxy]phenyl]ethanone
InChI:
InChI=1S/C15H13ClO2/c1-11(17)14-4-2-3-5-15(14)18-10-12-6-8-13(16)9-7-12/h2-9H,10H2,1H3
InChI Key:
JNNKBNAEBIMZBA-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)COc1ccccc1C(=O)C
Properties
Complexity:
272
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.06g/mol
Formal Charge:
0
Heavy Atom Count:
18
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
260.717g/mol
Monoisotopic Mass:
260.06g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
26.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.8
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