2,2,8,8-tetramethylpyrano[3,2-g]chromen-5-ol

C16H18O3 — CID 86035847

IUPAC2,2,8,8-tetramethylpyrano[3,2-g]chromen-5-ol
SMILESCC1(C)C=Cc2c(cc3c(c2O)C=CC(C)(C)O3)O1
InChIInChI=1S/C16H18O3/c1-15(2)7-5-10-12(18-15)9-13-11(14(10)17)6-8-16(3,4)19-13/h5-9,17H,1-4H3
InChIKeyXVLWJKPYEKBBOP-UHFFFAOYSA-N
MW258.32 g/mol
LogP3.76
Rot. Bonds

About 2,2,8,8-tetramethylpyrano[3,2-g]chromen-5-ol

2,2,8,8-tetramethylpyrano[3,2-g]chromen-5-ol (PubChem CID 86035847) has the molecular formula C16H18O3 and a molecular weight of 258.32 g/mol. Its IUPAC name is 2,2,8,8-tetramethylpyrano[3,2-g]chromen-5-ol.

Molecular Properties

Compound Name2,2,8,8-tetramethylpyrano[3,2-g]chromen-5-ol
PubChem CID86035847
Molecular FormulaC16H18O3
Molecular Weight258.32 g/mol
Exact Mass258.13
IUPAC Name2,2,8,8-tetramethylpyrano[3,2-g]chromen-5-ol
SMILESCC1(C)C=Cc2c(cc3c(c2O)C=CC(C)(C)O3)O1
InChIInChI=1S/C16H18O3/c1-15(2)7-5-10-12(18-15)9-13-11(14(10)17)6-8-16(3,4)19-13/h5-9,17H,1-4H3
InChIKeyXVLWJKPYEKBBOP-UHFFFAOYSA-N
XLogP3.76
TPSA38.69 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 53.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-hydroxy-2,2-dimethyl-8H-furo[3,4-g]chromen-6-one
CID 636462
7,7-dimethyl-8-oxatetracyclo[24.2.2.02,11.04,9]triaconta-1(28),2,4(9),5,10,26,29-heptaene-3,28,29-triol
CID 24761005
1-(7-hydroxy-2,2,5-trimethylchromen-6-yl)ethanone
CID 13462851
(7S,8S)-5,7-dihydroxy-8-(4-hydroxyphenyl)-2,2-dimethyl-7,8-dihydropyrano[3,2-g]chromen-6-one
CID 163070313
(7R,8S)-5-hydroxy-8-(2-hydroxyphenyl)-7-methoxy-2,2-dimethyl-7,8-dihydropyrano[3,2-g]chromen-6-one
CID 163019968
(7R,8R)-8-(2,4-dihydroxyphenyl)-5,7-dihydroxy-2,2-dimethyl-7,8-dihydropyrano[3,2-g]chromen-6-one
CID 71473387
5-hydroxy-7,8,9,10-tetramethoxy-2,2-dimethylpyrano[3,2-b]xanthen-6-one
CID 155528646
(6S)-10,10-dimethyl-6-prop-1-en-2-yl-5,6-dihydronaphtho[2,1-g]chromene-2,3,7-triol
CID 163013400
methyl 7-hydroxy-5-methoxy-2,2-dimethylchromene-6-carboxylate
CID 166070185
1-(5,6,7-trihydroxy-2,2-dimethylchromen-8-yl)ethanone
CID 150032259
1-(5,7-dimethoxy-2,2-dimethylchromen-6-yl)ethanone
CID 66573258
1-(5-hydroxy-2,2-dimethylchromen-6-yl)-2-(3-methoxy-4-methylphenyl)ethanone
CID 118199612

Frequently Asked Questions

What is the IUPAC name of 2,2,8,8-tetramethylpyrano[3,2-g]chromen-5-ol?
The IUPAC name of 2,2,8,8-tetramethylpyrano[3,2-g]chromen-5-ol (CID 86035847) is 2,2,8,8-tetramethylpyrano[3,2-g]chromen-5-ol.
What is the SMILES notation for 2,2,8,8-tetramethylpyrano[3,2-g]chromen-5-ol?
The canonical SMILES for 2,2,8,8-tetramethylpyrano[3,2-g]chromen-5-ol is CC1(C)C=Cc2c(cc3c(c2O)C=CC(C)(C)O3)O1.
What is the InChIKey of 2,2,8,8-tetramethylpyrano[3,2-g]chromen-5-ol?
The InChIKey is XVLWJKPYEKBBOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18O3/c1-15(2)7-5-10-12(18-15)9-13-11(14(10)17)6-8-16(3,4)19-13/h5-9,17H,1-4H3.
What are the key properties of 2,2,8,8-tetramethylpyrano[3,2-g]chromen-5-ol?
2,2,8,8-tetramethylpyrano[3,2-g]chromen-5-ol has a molecular weight of 258.32 g/mol, XLogP of 3.76, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,8,8-tetramethylpyrano[3,2-g]chromen-5-ol is sourced from PubChem (CID 86035847), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).