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Diphenethyl ketone

CAS No.:
5396-91-8
Catalog Number:
AG00DJWH
Molecular Formula:
Molecular Weight:
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Product Description
Catalog Number:
AG00DJWH
Chemical Name:
Diphenethyl ketone
CAS Number:
5396-91-8
MDL Number:
MFCD13478258
IUPAC Name:
1,5-diphenylpentan-3-one
InChI:
InChI=1S/C17H18O/c18-17(13-11-15-7-3-1-4-8-15)14-12-16-9-5-2-6-10-16/h1-10H,11-14H2
InChI Key:
JENANTGGBLOTIB-UHFFFAOYSA-N
Properties
Complexity:
210  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
238.136g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
238.33g/mol
Monoisotopic Mass:
238.136g/mol
Rotatable Bond Count:
6  
Topological Polar Surface Area:
17.1A^2
Undefined Atom Stereocenter Count:
1  
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Literature
Title Journal
Synthesis and antimalarial activity of dihydroperoxides and tetraoxanes conjugated with bis(benzyl)acetone derivatives. Chemical biology & drug design 20120501
Titanacyclobutenes or titanium vinyl carbene complexes? Reactivity of organotitanium species generated by the reaction of gamma-chloroallyl sulfides with a titanocene(II) reagent. Chemistry (Weinheim an der Bergstrasse, Germany) 20070101
Properties