cyclooctyl(1,3-dihydro-2-benzofuran-5-yl)methanol

C17H24O2 — CID 65023088

IUPACcyclooctyl(1,3-dihydro-2-benzofuran-5-yl)methanol
SMILESOC(c1ccc2c(c1)COC2)C1CCCCCCC1
InChIInChI=1S/C17H24O2/c18-17(13-6-4-2-1-3-5-7-13)14-8-9-15-11-19-12-16(15)10-14/h8-10,13,17-18H,1-7,11-12H2
InChIKeyDZZTVVKPSOMAMQ-UHFFFAOYSA-N
MW260.38 g/mol
LogP4.11
Rot. Bonds2

About cyclooctyl(1,3-dihydro-2-benzofuran-5-yl)methanol

cyclooctyl(1,3-dihydro-2-benzofuran-5-yl)methanol (PubChem CID 65023088) has the molecular formula C17H24O2 and a molecular weight of 260.38 g/mol. Its IUPAC name is cyclooctyl(1,3-dihydro-2-benzofuran-5-yl)methanol.

Molecular Properties

Compound Namecyclooctyl(1,3-dihydro-2-benzofuran-5-yl)methanol
PubChem CID65023088
Molecular FormulaC17H24O2
Molecular Weight260.38 g/mol
Exact Mass260.18
IUPAC Namecyclooctyl(1,3-dihydro-2-benzofuran-5-yl)methanol
SMILESOC(c1ccc2c(c1)COC2)C1CCCCCCC1
InChIInChI=1S/C17H24O2/c18-17(13-6-4-2-1-3-5-7-13)14-8-9-15-11-19-12-16(15)10-14/h8-10,13,17-18H,1-7,11-12H2
InChIKeyDZZTVVKPSOMAMQ-UHFFFAOYSA-N
XLogP4.11
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

cyclooctyl(1,3-dihydro-2-benzofuran-5-yl)methanamine
CID 65018267
cyclooctyl(5,6,7,8-tetrahydronaphthalen-2-yl)methanol
CID 65023370
5-[bromo(cyclopentyl)methyl]-1,3-dihydro-2-benzofuran
CID 63020800
1,3-benzodioxol-5-yl(cycloheptyl)methanol
CID 82929316
1,3-dihydro-2-benzofuran-5-yl-(2,2-dimethylcyclopropyl)methanol
CID 107002520
5-(1-chloro-2-cyclopentylethyl)-1,3-dihydro-2-benzofuran
CID 63019567
cyclopentyl-(2,2-dimethyl-3H-1-benzofuran-5-yl)methanol
CID 55061675
cyclooctyl-(3,4-dichlorophenyl)methanol
CID 65023087
(S)-cyclohexyl-(3,4-difluorophenyl)methanol
CID 93184621
(R)-cyclohexyl-(3,4-difluorophenyl)methanol
CID 93184618
5-[bromo(oxan-3-yl)methyl]-1,3-dihydro-2-benzofuran
CID 55144249
7-bicyclo[4.2.0]octa-1,3,5-trienyl(1,3-dihydro-2-benzofuran-5-yl)methanol
CID 66395379

Frequently Asked Questions

What is the IUPAC name of cyclooctyl(1,3-dihydro-2-benzofuran-5-yl)methanol?
The IUPAC name of cyclooctyl(1,3-dihydro-2-benzofuran-5-yl)methanol (CID 65023088) is cyclooctyl(1,3-dihydro-2-benzofuran-5-yl)methanol.
What is the SMILES notation for cyclooctyl(1,3-dihydro-2-benzofuran-5-yl)methanol?
The canonical SMILES for cyclooctyl(1,3-dihydro-2-benzofuran-5-yl)methanol is OC(c1ccc2c(c1)COC2)C1CCCCCCC1.
What is the InChIKey of cyclooctyl(1,3-dihydro-2-benzofuran-5-yl)methanol?
The InChIKey is DZZTVVKPSOMAMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24O2/c18-17(13-6-4-2-1-3-5-7-13)14-8-9-15-11-19-12-16(15)10-14/h8-10,13,17-18H,1-7,11-12H2.
What are the key properties of cyclooctyl(1,3-dihydro-2-benzofuran-5-yl)methanol?
cyclooctyl(1,3-dihydro-2-benzofuran-5-yl)methanol has a molecular weight of 260.38 g/mol, XLogP of 4.11, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclooctyl(1,3-dihydro-2-benzofuran-5-yl)methanol is sourced from PubChem (CID 65023088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).