6-(2-hydroxyethyl)-3,4-dihydro-2H-chromen-4-ol

C11H14O3 — CID 67687802

IUPAC6-(2-hydroxyethyl)-3,4-dihydro-2H-chromen-4-ol
SMILESOCCc1ccc2c(c1)C(O)CCO2
InChIInChI=1S/C11H14O3/c12-5-3-8-1-2-11-9(7-8)10(13)4-6-14-11/h1-2,7,10,12-13H,3-6H2
InChIKeyGDHNSAUMIGZESJ-UHFFFAOYSA-N
MW194.23 g/mol
LogP1.04
Rot. Bonds2

About 6-(2-hydroxyethyl)-3,4-dihydro-2H-chromen-4-ol

6-(2-hydroxyethyl)-3,4-dihydro-2H-chromen-4-ol (PubChem CID 67687802) has the molecular formula C11H14O3 and a molecular weight of 194.23 g/mol. Its IUPAC name is 6-(2-hydroxyethyl)-3,4-dihydro-2H-chromen-4-ol.

Molecular Properties

Compound Name6-(2-hydroxyethyl)-3,4-dihydro-2H-chromen-4-ol
PubChem CID67687802
Molecular FormulaC11H14O3
Molecular Weight194.23 g/mol
Exact Mass194.09
IUPAC Name6-(2-hydroxyethyl)-3,4-dihydro-2H-chromen-4-ol
SMILESOCCc1ccc2c(c1)C(O)CCO2
InChIInChI=1S/C11H14O3/c12-5-3-8-1-2-11-9(7-8)10(13)4-6-14-11/h1-2,7,10,12-13H,3-6H2
InChIKeyGDHNSAUMIGZESJ-UHFFFAOYSA-N
XLogP1.04
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.23
LogP ≤ 51.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-chloro-3,4-dihydro-2H-chromen-4-ol
CID 15148408
(4R)-6-iodo-3,4-dihydro-2H-chromen-4-ol
CID 58909283
(4R)-7-ethyl-3,4-dihydro-2H-chromen-4-ol
CID 69174288
(4S)-6-phenylmethoxy-3,4-dihydro-2H-chromen-4-ol
CID 79014406
(4S)-6-(2-methylbutan-2-yl)-3,4-dihydro-2H-chromen-4-ol
CID 79014479
3-[(4R)-4-amino-3,4-dihydro-2H-chromen-6-yl]propanoic acid
CID 165354380
6-(2-hydroxyethyl)-2,3-dihydro-1H-inden-1-ol;6-propyl-2,3-dihydro-1H-inden-1-ol
CID 160826780
6-fluoro-2H-chromene;6-fluoro-3,4-dihydro-2H-chromen-4-ol
CID 159963364
2-(4,4-dimethyl-2,3-dihydrochromen-6-yl)ethanol
CID 67687808
(5S)-7-phenyl-2,3,4,5-tetrahydro-1-benzoxepin-5-ol
CID 79014200
7-chloro-2,3,4,5-tetrahydro-1-benzoxepin-5-ol
CID 64981565
N-cyclopropyl-6-(2-methoxyethyl)-3,4-dihydro-2H-chromen-4-amine
CID 43512662

Frequently Asked Questions

What is the IUPAC name of 6-(2-hydroxyethyl)-3,4-dihydro-2H-chromen-4-ol?
The IUPAC name of 6-(2-hydroxyethyl)-3,4-dihydro-2H-chromen-4-ol (CID 67687802) is 6-(2-hydroxyethyl)-3,4-dihydro-2H-chromen-4-ol.
What is the SMILES notation for 6-(2-hydroxyethyl)-3,4-dihydro-2H-chromen-4-ol?
The canonical SMILES for 6-(2-hydroxyethyl)-3,4-dihydro-2H-chromen-4-ol is OCCc1ccc2c(c1)C(O)CCO2.
What is the InChIKey of 6-(2-hydroxyethyl)-3,4-dihydro-2H-chromen-4-ol?
The InChIKey is GDHNSAUMIGZESJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14O3/c12-5-3-8-1-2-11-9(7-8)10(13)4-6-14-11/h1-2,7,10,12-13H,3-6H2.
What are the key properties of 6-(2-hydroxyethyl)-3,4-dihydro-2H-chromen-4-ol?
6-(2-hydroxyethyl)-3,4-dihydro-2H-chromen-4-ol has a molecular weight of 194.23 g/mol, XLogP of 1.04, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-hydroxyethyl)-3,4-dihydro-2H-chromen-4-ol is sourced from PubChem (CID 67687802), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).