(4R)-7-ethyl-3,4-dihydro-2H-chromen-4-ol

C11H14O2 — CID 69174288

IUPAC(4R)-7-ethyl-3,4-dihydro-2H-chromen-4-ol
SMILESCCc1ccc2c(c1)OCC[C@H]2O
InChIInChI=1S/C11H14O2/c1-2-8-3-4-9-10(12)5-6-13-11(9)7-8/h3-4,7,10,12H,2,5-6H2,1H3/t10-/m1/s1
InChIKeyYTRVPECLCSSNNS-SNVBAGLBSA-N
MW178.23 g/mol
LogP2.06
Rot. Bonds1

About (4R)-7-ethyl-3,4-dihydro-2H-chromen-4-ol

(4R)-7-ethyl-3,4-dihydro-2H-chromen-4-ol (PubChem CID 69174288) has the molecular formula C11H14O2 and a molecular weight of 178.23 g/mol. Its IUPAC name is (4R)-7-ethyl-3,4-dihydro-2H-chromen-4-ol.

Molecular Properties

Compound Name(4R)-7-ethyl-3,4-dihydro-2H-chromen-4-ol
PubChem CID69174288
Molecular FormulaC11H14O2
Molecular Weight178.23 g/mol
Exact Mass178.10
IUPAC Name(4R)-7-ethyl-3,4-dihydro-2H-chromen-4-ol
SMILESCCc1ccc2c(c1)OCC[C@H]2O
InChIInChI=1S/C11H14O2/c1-2-8-3-4-9-10(12)5-6-13-11(9)7-8/h3-4,7,10,12H,2,5-6H2,1H3/t10-/m1/s1
InChIKeyYTRVPECLCSSNNS-SNVBAGLBSA-N
XLogP2.06
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 ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

7-ethyl-3,4-dihydro-2H-chromen-4-amine
CID 55294378
(4R)-7-(methylamino)-3,4-dihydro-2H-chromen-4-ol
CID 69173568
(4S)-7-iodo-3,4-dihydro-2H-chromen-4-ol
CID 130741729
(4R)-7-chloro-3,4-dihydro-2H-chromen-4-ol
CID 79002138
11,24-diethyl-2,5,8,15,18,21-hexaoxatricyclo[20.4.0.09,14]hexacosa-1(22),9(14),10,12,23,25-hexaene
CID 3355803
6-(2-hydroxyethyl)-3,4-dihydro-2H-chromen-4-ol
CID 67687802
(6-ethyl-3,4-dihydro-2H-chromen-4-yl)methanamine
CID 82075648
(4S)-6-ethyl-3,4-dihydro-2H-chromen-4-amine;hydrochloride
CID 75412144
(4R)-7-[tert-butyl(dimethyl)silyl]oxy-3,4-dihydro-2H-chromen-4-ol
CID 129403845
(4S)-7-[tert-butyl(dimethyl)silyl]oxy-3,4-dihydro-2H-chromen-4-ol
CID 129403844
6-ethyl-2,3-dihydro-1-benzofuran
CID 59981216
(4S)-6-(2-methylbutan-2-yl)-3,4-dihydro-2H-chromen-4-ol
CID 79014479

Frequently Asked Questions

What is the IUPAC name of (4R)-7-ethyl-3,4-dihydro-2H-chromen-4-ol?
The IUPAC name of (4R)-7-ethyl-3,4-dihydro-2H-chromen-4-ol (CID 69174288) is (4R)-7-ethyl-3,4-dihydro-2H-chromen-4-ol.
What is the SMILES notation for (4R)-7-ethyl-3,4-dihydro-2H-chromen-4-ol?
The canonical SMILES for (4R)-7-ethyl-3,4-dihydro-2H-chromen-4-ol is CCc1ccc2c(c1)OCC[C@H]2O.
What is the InChIKey of (4R)-7-ethyl-3,4-dihydro-2H-chromen-4-ol?
The InChIKey is YTRVPECLCSSNNS-SNVBAGLBSA-N. The full InChI is InChI=1S/C11H14O2/c1-2-8-3-4-9-10(12)5-6-13-11(9)7-8/h3-4,7,10,12H,2,5-6H2,1H3/t10-/m1/s1.
What are the key properties of (4R)-7-ethyl-3,4-dihydro-2H-chromen-4-ol?
(4R)-7-ethyl-3,4-dihydro-2H-chromen-4-ol has a molecular weight of 178.23 g/mol, XLogP of 2.06, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-7-ethyl-3,4-dihydro-2H-chromen-4-ol is sourced from PubChem (CID 69174288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).