Chemical ID: 3965130

c1cc(ccc1C2CC(=O)c3ccc(cc3O2)O)O
Chemical ID:
3965130
Name [?]:
7-hydroxy-2-(4-hydroxyphenyl)-chroman-4-one
SMILES [?]:
c1cc(ccc1C2CC(=O)c3ccc(cc3O2)O)O
InChi [?]:
InChI=1/C15H12O4/c16-10-3-1-9(2-4-10)14-8-13(18)12-6-5-11(17)7-15(12)19-14/h1-7,14,16-17H,8H2
InChi Info:
AuxInfo=1/0/N:1,5,2,4,13,12,15,8,6,3,14,11,9,7,16,19,18,10,17/E:(1,2)(3,4)/rA:19cCCCCCCCCCOCCCCCCOOO/rB:s1;d2;s3;d4;d1s5;s6;s7;s8;d9;s9;s11;d12;s13;d14;d11s15;s7s16;s14;s3;/rC:;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C15H12O4
All Atoms:19
Heavy Atoms:19
Chiral Atoms:1
ZAP Information [?]
Total:6.57921
Area:431.336
Solvation:-4.2042
Coulombic:-47.9897
Bond Count [?]
All:21
Single:14
Double:7
Rotors:1
Chiral:0
Rigid Segments:2
Chemical Properties
Molecular Weight:256.253
H-Bond Donors:2
H-Bond Acceptors:4
XLogP:1.98
LogP (Chemaxon):2.27

Name Annotations

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Descriptor Annotations

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