Chemical ID: 4269877

c1ccc(cc1)C2C3Cc4ccccc4OC3c5ccccc5O2
Chemical ID:
4269877
Name [?]:
None
SMILES [?]:
c1ccc(cc1)C2C3Cc4ccccc4OC3c5ccccc5O2
InChi [?]:
InChI=1/C22H18O2/c1-2-8-15(9-3-1)21-18-14-16-10-4-6-12-19(16)23-22(18)17-11-5-7-13-20(17)24-21/h1-13,18,21-22H,14H2
InChi Info:
AuxInfo=1/0/N:1,2,6,12,20,13,21,3,5,11,19,14,22,9,4,10,18,8,15,23,7,17,16,24/E:(2,3)(8,9)/rA:24cCCCCCCCCCCCCCCCOCCCCCCCO/rB:s1;d2;s3;d4;d1s5;s4;s7;s8;s9;s10;d11;s12;d13;d10s14;s15;s8s16;s17;s18;d19;s20;d21;d18s22;s7s23;/rC:;;;;;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C22H18O2
All Atoms:24
Heavy Atoms:24
Chiral Atoms:3
ZAP Information [?]
Total:7.90653
Area:462.123
Solvation:-3.64655
Coulombic:-19.0276
Bond Count [?]
All:28
Single:19
Double:9
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:314.377
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:5.35
LogP (Chemaxon):5.18

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Descriptor Annotations

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