CID 59269508

C11H12O3 — CID 59269508

IUPAC—
SMILES[CH]C1COC(c2ccc(OC)cc2)O1
InChIInChI=1S/C11H12O3/c1-8-7-13-11(14-8)9-3-5-10(12-2)6-4-9/h1,3-6,8,11H,7H2,2H3
InChIKeyAWNZYWGRZAHYHR-UHFFFAOYSA-N
MW192.21 g/mol
LogP1.82
Rot. Bonds2

About CID 59269508

CID 59269508 (PubChem CID 59269508) has the molecular formula C11H12O3 and a molecular weight of 192.21 g/mol.

Molecular Properties

Compound NameCID 59269508
PubChem CID59269508
Molecular FormulaC11H12O3
Molecular Weight192.21 g/mol
Exact Mass192.08
IUPAC Name—
SMILES[CH]C1COC(c2ccc(OC)cc2)O1
InChIInChI=1S/C11H12O3/c1-8-7-13-11(14-8)9-3-5-10(12-2)6-4-9/h1,3-6,8,11H,7H2,2H3
InChIKeyAWNZYWGRZAHYHR-UHFFFAOYSA-N
XLogP1.82
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.21
LogP ≤ 51.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(2S,4R,5R)-4-[(2R,4R,5R)-5-hydroxy-2-(4-methoxyphenyl)-1,3-dioxan-4-yl]-2-(4-methoxyphenyl)-1,3-dioxan-5-ol
CID 86310159
(2S,4S,5S)-2-(4-methoxyphenyl)-4-[(2S,4S,5S)-2-(4-methoxyphenyl)-5-methyl-1,3-dioxan-4-yl]-5-methyl-1,3-dioxane
CID 11825831
2-(4-methoxyphenyl)-1,3-dioxan-5-ol
CID 13478629
(5S)-4-ethynyl-2-(4-methoxyphenyl)-1,3-dioxan-5-amine
CID 137402666
(2R,4R,5R)-5-hydroxy-2-(4-methoxyphenyl)-1,3-dioxane-4-carbaldehyde
CID 132574699
1-[[(2S,4R)-2-(4-methoxyphenyl)-1,3-dioxolan-4-yl]methyl]piperidin-1-ium
CID 6935772
(7aS)-2-(4-methoxyphenyl)-4,4a,5,6,7,7a-hexahydrocyclopenta[d][1,3]dioxin-6-amine
CID 67372159
(1R,3S,4S,6S,9S,11R)-3-ethyl-11-(4-methoxyphenyl)-2,5,10,12-tetraoxatricyclo[7.4.0.04,6]tridecane
CID 11034557
(2S,4S,5S)-4-[(2S,4R)-3-methoxy-4-[(2R,4R,5R)-2-(4-methoxyphenyl)-5-methyl-1,3-dioxan-4-yl]pentan-2-yl]-2-(4-methoxyphenyl)-5-methyl-1,3-dioxane
CID 11733998
(4R,6R)-2-(4-methoxyphenyl)-4,6-dimethyl-1,3-dioxane
CID 25233008
(2S)-2-[(4S,5S)-2-(4-methoxyphenyl)-5-methyl-1,3-dioxan-4-yl]propan-1-ol
CID 11054609
(4aR,6S,8aS)-6-ethenyl-2-(4-methoxyphenyl)-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxine
CID 167262418

Frequently Asked Questions

What is the IUPAC name of CID 59269508?
The IUPAC name of CID 59269508 (CID 59269508) is not available.
What is the SMILES notation for CID 59269508?
The canonical SMILES for CID 59269508 is [CH]C1COC(c2ccc(OC)cc2)O1.
What is the InChIKey of CID 59269508?
The InChIKey is AWNZYWGRZAHYHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12O3/c1-8-7-13-11(14-8)9-3-5-10(12-2)6-4-9/h1,3-6,8,11H,7H2,2H3.
What are the key properties of CID 59269508?
CID 59269508 has a molecular weight of 192.21 g/mol, XLogP of 1.82, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 59269508 is sourced from PubChem (CID 59269508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).