Chemical ID: 6874764

Cc1ccc2c(c1)c(=O)c(c(o2)c3ccccc3Cl)OCc4ccccc4
Chemical ID:
6874764
Name [?]:
3-benzyloxy-2-(2-chlorophenyl)-6-methyl-chromen-4-one
SMILES [?]:
Cc1ccc2c(c1)c(=O)c(c(o2)c3ccccc3Cl)OCc4ccccc4
InChi [?]:
InChI=1/C23H17ClO3/c1-15-11-12-20-18(13-15)21(25)23(26-14-16-7-3-2-4-8-16)22(27-20)17-9-5-6-10-19(17)24/h2-13H,14H2,1H3
InChi Info:
AuxInfo=1/0/N:1,25,24,26,15,16,23,27,14,17,3,4,7,21,2,22,13,6,18,5,8,11,10,19,9,20,12/E:(3,4)(7,8)/rA:27nCCCCCCCCOCCOCCCCCCClOCCCCCCC/rB:s1;s2;d3;s4;d5;d2s6;s6;d8;s8;d10;s5s11;s11;s13;d14;s15;d16;d13s17;s18;s10;s20;s21;s22;d23;s24;d25;d22s26;/rC:;;;;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C23H17ClO3
All Atoms:44
Heavy Atoms:27
Chiral Atoms:0
ZAP Information [?]
Total:11.0677
Area:560.281
Solvation:-2.9393
Coulombic:-29.9498
Bond Count [?]
All:30
Single:19
Double:11
Rotors:4
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:376.832
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:6.64
LogP (Chemaxon):6.13

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Descriptor Annotations

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