4-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)-6,7-dihydro-5H-1-benzofuran-4-ol

C19H22O2 — CID 115467078

IUPAC4-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)-6,7-dihydro-5H-1-benzofuran-4-ol
SMILESOC1(CC2CCCc3ccccc32)CCCc2occc21
InChIInChI=1S/C19H22O2/c20-19(11-4-9-18-17(19)10-12-21-18)13-15-7-3-6-14-5-1-2-8-16(14)15/h1-2,5,8,10,12,15,20H,3-4,6-7,9,11,13H2
InChIKeyUVWOUTMYMFSYFF-UHFFFAOYSA-N
MW282.38 g/mol
LogP4.31
Rot. Bonds2

About 4-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)-6,7-dihydro-5H-1-benzofuran-4-ol

4-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)-6,7-dihydro-5H-1-benzofuran-4-ol (PubChem CID 115467078) has the molecular formula C19H22O2 and a molecular weight of 282.38 g/mol. Its IUPAC name is 4-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)-6,7-dihydro-5H-1-benzofuran-4-ol.

Molecular Properties

Compound Name4-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)-6,7-dihydro-5H-1-benzofuran-4-ol
PubChem CID115467078
Molecular FormulaC19H22O2
Molecular Weight282.38 g/mol
Exact Mass282.16
IUPAC Name4-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)-6,7-dihydro-5H-1-benzofuran-4-ol
SMILESOC1(CC2CCCc3ccccc32)CCCc2occc21
InChIInChI=1S/C19H22O2/c20-19(11-4-9-18-17(19)10-12-21-18)13-15-7-3-6-14-5-1-2-8-16(14)15/h1-2,5,8,10,12,15,20H,3-4,6-7,9,11,13H2
InChIKeyUVWOUTMYMFSYFF-UHFFFAOYSA-N
XLogP4.31
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.38
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)-2,3-dihydroinden-1-ol
CID 63772638
4-(cyclohexylmethyl)-6,7-dihydro-5H-1-benzofuran-4-ol
CID 115466959
1,1-dioxo-3-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)thiolan-3-ol
CID 55243248
1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)cyclopentan-1-amine
CID 63772469
3-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)pyrrolidin-3-ol
CID 63772132
1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)cycloheptan-1-amine
CID 55243443
1-[2-(1,2,3,4-tetrahydronaphthalen-1-yl)ethyl]-1,2,3,4-tetrahydronaphthalene
CID 15742901
1-(iodomethyl)-1,2,3,4-tetrahydronaphthalene
CID 2763030
1-(bromomethyl)-1,2,3,4-tetrahydronaphthalene
CID 13067239
1,1-dioxo-3-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)thiolane-3-carboxylic acid
CID 115337961
2-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)-1,3,2-dioxazolidine-4,5-dione
CID 44784874
4-methyl-1-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)cyclohexane-1-carboxylic acid
CID 79423048

Frequently Asked Questions

What is the IUPAC name of 4-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)-6,7-dihydro-5H-1-benzofuran-4-ol?
The IUPAC name of 4-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)-6,7-dihydro-5H-1-benzofuran-4-ol (CID 115467078) is 4-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)-6,7-dihydro-5H-1-benzofuran-4-ol.
What is the SMILES notation for 4-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)-6,7-dihydro-5H-1-benzofuran-4-ol?
The canonical SMILES for 4-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)-6,7-dihydro-5H-1-benzofuran-4-ol is OC1(CC2CCCc3ccccc32)CCCc2occc21.
What is the InChIKey of 4-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)-6,7-dihydro-5H-1-benzofuran-4-ol?
The InChIKey is UVWOUTMYMFSYFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22O2/c20-19(11-4-9-18-17(19)10-12-21-18)13-15-7-3-6-14-5-1-2-8-16(14)15/h1-2,5,8,10,12,15,20H,3-4,6-7,9,11,13H2.
What are the key properties of 4-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)-6,7-dihydro-5H-1-benzofuran-4-ol?
4-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)-6,7-dihydro-5H-1-benzofuran-4-ol has a molecular weight of 282.38 g/mol, XLogP of 4.31, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1,2,3,4-tetrahydronaphthalen-1-ylmethyl)-6,7-dihydro-5H-1-benzofuran-4-ol is sourced from PubChem (CID 115467078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).