2-phenyl-3,4-dihydro-2H-chromene-3,4,5,7-tetrol

C15H14O5 — CID 66548355

IUPAC2-phenyl-3,4-dihydro-2H-chromene-3,4,5,7-tetrol
SMILESOc1cc(O)c2c(c1)OC(c1ccccc1)C(O)C2O
InChIInChI=1S/C15H14O5/c16-9-6-10(17)12-11(7-9)20-15(14(19)13(12)18)8-4-2-1-3-5-8/h1-7,13-19H
InChIKeyMTOGKBVCUVCNIM-UHFFFAOYSA-N
MW274.27 g/mol
LogP1.63
Rot. Bonds1

About 2-phenyl-3,4-dihydro-2H-chromene-3,4,5,7-tetrol

2-phenyl-3,4-dihydro-2H-chromene-3,4,5,7-tetrol (PubChem CID 66548355) has the molecular formula C15H14O5 and a molecular weight of 274.27 g/mol. Its IUPAC name is 2-phenyl-3,4-dihydro-2H-chromene-3,4,5,7-tetrol.

Molecular Properties

Compound Name2-phenyl-3,4-dihydro-2H-chromene-3,4,5,7-tetrol
PubChem CID66548355
Molecular FormulaC15H14O5
Molecular Weight274.27 g/mol
Exact Mass274.08
IUPAC Name2-phenyl-3,4-dihydro-2H-chromene-3,4,5,7-tetrol
SMILESOc1cc(O)c2c(c1)OC(c1ccccc1)C(O)C2O
InChIInChI=1S/C15H14O5/c16-9-6-10(17)12-11(7-9)20-15(14(19)13(12)18)8-4-2-1-3-5-8/h1-7,13-19H
InChIKeyMTOGKBVCUVCNIM-UHFFFAOYSA-N
XLogP1.63
TPSA90.15 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.27
LogP ≤ 51.63
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

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Related Compounds

(2R,3R)-2-phenyl-8-[(2R,3R,4R)-3,5,7-trihydroxy-2-phenyl-3,4-dihydro-2H-chromen-4-yl]-3,4-dihydro-2H-chromene-3,5,7-triol
CID 14281803
2-(3,4-dihydroxyphenyl)-8-[2-(3,4-dihydroxyphenyl)-8-[2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-4-yl]-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-4-yl]-3,4-dihydro-2H-chromene-3,4,5,7-tetrol
CID 102304657
2-phenyl-2,4-dihydrochromene-3,3,4,5,7-pentol
CID 70700187
(2S,3R,4R)-3,4-dihydroxy-7-methyl-2-phenyl-3,4-dihydro-2H-pyrano[3,2-c]pyran-5-one
CID 101151989
(2R,3S,4S)-4-benzylsulfanyl-2-(3,4,5-trihydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol
CID 93477121
4,15-bis(3,5-dihydroxyphenyl)-5,11,16-tris(4-hydroxyphenyl)-22-phenyl-6,17-dioxahexacyclo[10.10.0.02,10.03,7.013,21.014,18]docosa-2(10),3(7),8,13(21),14(18),19-hexaene-9,20-diol
CID 162982892
2-(3-hydroxyphenyl)-3,4-dihydro-2H-chromene-3,4,7-triol
CID 101141276
(2R,3S,4R)-4-(2,4-dihydroxy-6-methylphenyl)-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromene-3,7-diol
CID 162952833
(2R,3R,4R)-4-[2-[2-(3,4-dihydroxyphenyl)ethenyl]-4,6-dihydroxyphenyl]-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromene-3,7-diol
CID 162901895
5,7-dihydroxy-3-methoxy-2-phenyl-2,3-dihydrochromen-4-one
CID 14794877
3-(hydroxymethyl)-2-methyl-3,4-dihydro-2H-chromene-4,5,7-triol
CID 162376828
(2R,3R)-8-[(2R,3R,4R)-2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-3,4-dihydro-2H-chromen-4-yl]-2-(4-hydroxyphenyl)-3,4-dihydro-2H-chromene-3,5,7-triol
CID 14015948

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-3,4-dihydro-2H-chromene-3,4,5,7-tetrol?
The IUPAC name of 2-phenyl-3,4-dihydro-2H-chromene-3,4,5,7-tetrol (CID 66548355) is 2-phenyl-3,4-dihydro-2H-chromene-3,4,5,7-tetrol.
What is the SMILES notation for 2-phenyl-3,4-dihydro-2H-chromene-3,4,5,7-tetrol?
The canonical SMILES for 2-phenyl-3,4-dihydro-2H-chromene-3,4,5,7-tetrol is Oc1cc(O)c2c(c1)OC(c1ccccc1)C(O)C2O.
What is the InChIKey of 2-phenyl-3,4-dihydro-2H-chromene-3,4,5,7-tetrol?
The InChIKey is MTOGKBVCUVCNIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14O5/c16-9-6-10(17)12-11(7-9)20-15(14(19)13(12)18)8-4-2-1-3-5-8/h1-7,13-19H.
What are the key properties of 2-phenyl-3,4-dihydro-2H-chromene-3,4,5,7-tetrol?
2-phenyl-3,4-dihydro-2H-chromene-3,4,5,7-tetrol has a molecular weight of 274.27 g/mol, XLogP of 1.63, 1 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-3,4-dihydro-2H-chromene-3,4,5,7-tetrol is sourced from PubChem (CID 66548355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).