Chemical ID: 5187174

c1ccc2cc(ccc2c1)C(=O)C=Cc3cccc4c3cccc4
Chemical ID:
5187174
Name [?]:
3-(1-naphthyl)-1-(2-naphthyl)prop-2-en-1-one
SMILES [?]:
c1ccc2cc(ccc2c1)C(=O)C=Cc3cccc4c3cccc4
InChi [?]:
InChI=1/C23H16O/c24-23(21-13-12-17-6-1-2-8-20(17)16-21)15-14-19-10-5-9-18-7-3-4-11-22(18)19/h1-16H
InChi Info:
AuxInfo=1/0/N:1,2,23,22,17,10,24,3,18,16,21,8,7,14,13,5,9,19,15,4,6,20,11,12/rA:24nCCCCCCCCCCCOCCCCCCCCCCCC/rB:s1;d2;s3;s4;d5;s6;d7;d4s8;d1s9;s6;d11;s11;w13;s14;s15;d16;s17;d18;d15s19;s20;d21;s22;s19d23;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C23H16O
All Atoms:24
Heavy Atoms:24
Chiral Atoms:0
ZAP Information [?]
Total:10.0746
Area:504.705
Solvation:-2.54301
Coulombic:-13.0522
Bond Count [?]
All:27
Single:15
Double:12
Rotors:3
Chiral:1
Rigid Segments:4
Chemical Properties
Molecular Weight:308.373
H-Bond Donors:0
H-Bond Acceptors:1
XLogP:6.38
LogP (Chemaxon):6.02

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Descriptor Annotations

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