Chemical ID: 4860599

Cc1ccc2c(c1)c(=O)cc(o2)c3ccccc3OC
Chemical ID:
4860599
Name [?]:
2-(2-methoxyphenyl)-6-methyl-chromen-4-one
SMILES [?]:
Cc1ccc2c(c1)c(=O)cc(o2)c3ccccc3OC
InChi [?]:
InChI=1/C17H14O3/c1-11-7-8-16-13(9-11)14(18)10-17(20-16)12-5-3-4-6-15(12)19-2/h3-10H,1-2H3
InChi Info:
AuxInfo=1/0/N:1,20,15,16,14,17,3,4,7,10,2,13,6,8,18,5,11,9,19,12/rA:20nCCCCCCCCOCCOCCCCCCOC/rB:s1;s2;d3;s4;d5;d2s6;s6;d8;s8;d10;s5s11;s11;s13;d14;s15;d16;d13s17;s18;s19;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H14O3
All Atoms:20
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:7.40802
Area:448.131
Solvation:-3.79526
Coulombic:-24.1675
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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Descriptor Annotations

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