3,4-dihydro-2H-chromen-3-ol

C9H10O2 — CID 591520

IUPAC3,4-dihydro-2H-chromen-3-ol
SMILESOC1COc2ccccc2C1
InChIInChI=1S/C9H10O2/c10-8-5-7-3-1-2-4-9(7)11-6-8/h1-4,8,10H,5-6H2
InChIKeyHBLDKCGIBIGVPC-UHFFFAOYSA-N
MW150.18 g/mol
LogP0.98
Rot. Bonds

About 3,4-dihydro-2H-chromen-3-ol

3,4-dihydro-2H-chromen-3-ol (PubChem CID 591520) has the molecular formula C9H10O2 and a molecular weight of 150.18 g/mol. Its IUPAC name is 3,4-dihydro-2H-chromen-3-ol.

Molecular Properties

Compound Name3,4-dihydro-2H-chromen-3-ol
PubChem CID591520
Molecular FormulaC9H10O2
Molecular Weight150.18 g/mol
Exact Mass150.07
IUPAC Name3,4-dihydro-2H-chromen-3-ol
SMILESOC1COc2ccccc2C1
InChIInChI=1S/C9H10O2/c10-8-5-7-3-1-2-4-9(7)11-6-8/h1-4,8,10H,5-6H2
InChIKeyHBLDKCGIBIGVPC-UHFFFAOYSA-N
XLogP0.98
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.18
LogP ≤ 50.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3,4-dihydro-2H-chromen-3-ol?
The IUPAC name of 3,4-dihydro-2H-chromen-3-ol (CID 591520) is 3,4-dihydro-2H-chromen-3-ol.
What is the SMILES notation for 3,4-dihydro-2H-chromen-3-ol?
The canonical SMILES for 3,4-dihydro-2H-chromen-3-ol is OC1COc2ccccc2C1.
What is the InChIKey of 3,4-dihydro-2H-chromen-3-ol?
The InChIKey is HBLDKCGIBIGVPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10O2/c10-8-5-7-3-1-2-4-9(7)11-6-8/h1-4,8,10H,5-6H2.
What are the key properties of 3,4-dihydro-2H-chromen-3-ol?
3,4-dihydro-2H-chromen-3-ol has a molecular weight of 150.18 g/mol, XLogP of 0.98, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dihydro-2H-chromen-3-ol is sourced from PubChem (CID 591520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).