[(3R)-3-methyl-2,4-dihydrochromen-3-yl]methanol

C11H14O2 — CID 132962049

IUPAC[(3R)-3-methyl-2,4-dihydrochromen-3-yl]methanol
SMILESC[C@@]1(CO)COc2ccccc2C1
InChIInChI=1S/C11H14O2/c1-11(7-12)6-9-4-2-3-5-10(9)13-8-11/h2-5,12H,6-8H2,1H3/t11-/m1/s1
InChIKeyHOEYCPFZFYJQBE-LLVKDONJSA-N
MW178.23 g/mol
LogP1.62
Rot. Bonds1

About [(3R)-3-methyl-2,4-dihydrochromen-3-yl]methanol

[(3R)-3-methyl-2,4-dihydrochromen-3-yl]methanol (PubChem CID 132962049) has the molecular formula C11H14O2 and a molecular weight of 178.23 g/mol. Its IUPAC name is [(3R)-3-methyl-2,4-dihydrochromen-3-yl]methanol.

Molecular Properties

Compound Name[(3R)-3-methyl-2,4-dihydrochromen-3-yl]methanol
PubChem CID132962049
Molecular FormulaC11H14O2
Molecular Weight178.23 g/mol
Exact Mass178.10
IUPAC Name[(3R)-3-methyl-2,4-dihydrochromen-3-yl]methanol
SMILESC[C@@]1(CO)COc2ccccc2C1
InChIInChI=1S/C11H14O2/c1-11(7-12)6-9-4-2-3-5-10(9)13-8-11/h2-5,12H,6-8H2,1H3/t11-/m1/s1
InChIKeyHOEYCPFZFYJQBE-LLVKDONJSA-N
XLogP1.62
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.23
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of [(3R)-3-methyl-2,4-dihydrochromen-3-yl]methanol?
The IUPAC name of [(3R)-3-methyl-2,4-dihydrochromen-3-yl]methanol (CID 132962049) is [(3R)-3-methyl-2,4-dihydrochromen-3-yl]methanol.
What is the SMILES notation for [(3R)-3-methyl-2,4-dihydrochromen-3-yl]methanol?
The canonical SMILES for [(3R)-3-methyl-2,4-dihydrochromen-3-yl]methanol is C[C@@]1(CO)COc2ccccc2C1.
What is the InChIKey of [(3R)-3-methyl-2,4-dihydrochromen-3-yl]methanol?
The InChIKey is HOEYCPFZFYJQBE-LLVKDONJSA-N. The full InChI is InChI=1S/C11H14O2/c1-11(7-12)6-9-4-2-3-5-10(9)13-8-11/h2-5,12H,6-8H2,1H3/t11-/m1/s1.
What are the key properties of [(3R)-3-methyl-2,4-dihydrochromen-3-yl]methanol?
[(3R)-3-methyl-2,4-dihydrochromen-3-yl]methanol has a molecular weight of 178.23 g/mol, XLogP of 1.62, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(3R)-3-methyl-2,4-dihydrochromen-3-yl]methanol is sourced from PubChem (CID 132962049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).