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17580-20-0 | 1-Propanone, 1-[1,1'-biphenyl]-4-yl-3-chloro-
CAS No: 17580-20-0 Catalog No: AG002179 MDL No:
Product Description
Catalog Number:
AG002179
Chemical Name:
1-Propanone, 1-[1,1'-biphenyl]-4-yl-3-chloro-
CAS Number:
17580-20-0
Molecular Formula:
C15H13ClO
Molecular Weight:
244.7161
IUPAC Name:
3-chloro-1-(4-phenylphenyl)propan-1-one
InChI:
InChI=1S/C15H13ClO/c16-11-10-15(17)14-8-6-13(7-9-14)12-4-2-1-3-5-12/h1-9H,10-11H2
InChI Key:
WOWJDSIOZZVYNR-UHFFFAOYSA-N
SMILES:
ClCCC(=O)c1ccc(cc1)c1ccccc1
NSC Number:
36078
Properties
Complexity:
237
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
244.065g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
1
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
244.718g/mol
Monoisotopic Mass:
244.065g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4.3
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