Chemical ID: 3967451

Cc1cc(cc2c1c(=O)cc(o2)c3ccccc3)OC
Chemical ID:
3967451
Name [?]:
7-methoxy-5-methyl-2-phenyl-chromen-4-one
SMILES [?]:
Cc1cc(cc2c1c(=O)cc(o2)c3ccccc3)OC
InChi [?]:
InChI=1/C17H14O3/c1-11-8-13(19-2)9-16-17(11)14(18)10-15(20-16)12-6-4-3-5-7-12/h3-10H,1-2H3
InChi Info:
AuxInfo=1/0/N:1,20,16,15,17,14,18,3,5,10,2,13,4,8,11,6,7,9,19,12/E:(4,5)(6,7)/rA:20nCCCCCCCCOCCOCCCCCCOC/rB:s1;s2;d3;s4;d5;d2s6;s7;d8;s8;d10;s6s11;s11;s13;d14;s15;d16;d13s17;s4;s19;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H14O3
All Atoms:20
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:7.99976
Area:444.597
Solvation:-3.11517
Coulombic:-24.6854
Bond Count [?]
All:22
Single:14
Double:8
Rotors:2
Chiral:0
Rigid Segments:3
Chemical Properties
Molecular Weight:266.291
H-Bond Donors:0
H-Bond Acceptors:2
XLogP:3.98
LogP (Chemaxon):3.83

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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