Chemical ID: 4855181

Cc1c(c(=O)c2ccc(cc2o1)OC)c3ccccc3
Chemical ID:
4855181
Name [?]:
7-methoxy-2-methyl-3-phenyl-chromen-4-one
SMILES [?]:
Cc1c(c(=O)c2ccc(cc2o1)OC)c3ccccc3
InChi [?]:
InChI=1/C17H14O3/c1-11-16(12-6-4-3-5-7-12)17(18)14-9-8-13(19-2)10-15(14)20-11/h3-10H,1-2H3
InChi Info:
AuxInfo=1/0/N:1,14,18,17,19,16,20,8,7,10,2,15,9,6,11,3,4,5,13,12/E:(4,5)(6,7)/rA:20nCCCCOCCCCCCOOCCCCCCC/rB:s1;d2;s3;d4;s4;s6;d7;s8;d9;d6s10;s2s11;s9;s13;s3;s15;d16;s17;d18;d15s19;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C17H14O3
All Atoms:20
Heavy Atoms:20
Chiral Atoms:0
ZAP Information [?]
Total:7.86053
Area:446.421
Solvation:-3.29999
Coulombic:-24.6351
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:3.69
LogP (Chemaxon):3.62

Name Annotations

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Descriptor Annotations

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