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53115-02-9 | 2,6-BIS((E)-2-[1-ETHYL-2(1H)-QUINOLINYLIDENE]ETHYLIDENE)CYCLOHEXANONE
CAS No: 53115-02-9 Catalog No: AG00DP6U MDL No:
Product Description
Catalog Number:
AG00DP6U
Chemical Name:
2,6-BIS((E)-2-[1-ETHYL-2(1H)-QUINOLINYLIDENE]ETHYLIDENE)CYCLOHEXANONE
CAS Number:
53115-02-9
IUPAC Name:
2,6-bis[2-(1-ethylquinolin-2-ylidene)ethylidene]cyclohexan-1-one
InChI:
InChI=1S/C32H32N2O/c1-3-33-28(20-16-24-10-5-7-14-30(24)33)22-18-26-12-9-13-27(32(26)35)19-23-29-21-17-25-11-6-8-15-31(25)34(29)4-2/h5-8,10-11,14-23H,3-4,9,12-13H2,1-2H3
InChI Key:
KLXRNHZEECPZDR-UHFFFAOYSA-N
Properties
Complexity:
902
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
460.251g/mol
Formal Charge:
0
Heavy Atom Count:
35
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
460.621g/mol
Monoisotopic Mass:
460.251g/mol
Rotatable Bond Count:
4
Topological Polar Surface Area:
23.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
4
XLogP3:
7.8
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