6-bromo-2-(furan-2-yl)-3,4-dihydro-1H-naphthalen-2-ol

C14H13BrO2 — CID 63948544

IUPAC6-bromo-2-(furan-2-yl)-3,4-dihydro-1H-naphthalen-2-ol
SMILESOC1(c2ccco2)CCc2cc(Br)ccc2C1
InChIInChI=1S/C14H13BrO2/c15-12-4-3-11-9-14(16,6-5-10(11)8-12)13-2-1-7-17-13/h1-4,7-8,16H,5-6,9H2
InChIKeyZAQFHLUSTJMHQX-UHFFFAOYSA-N
MW293.16 g/mol
LogP3.42
Rot. Bonds1

About 6-bromo-2-(furan-2-yl)-3,4-dihydro-1H-naphthalen-2-ol

6-bromo-2-(furan-2-yl)-3,4-dihydro-1H-naphthalen-2-ol (PubChem CID 63948544) has the molecular formula C14H13BrO2 and a molecular weight of 293.16 g/mol. Its IUPAC name is 6-bromo-2-(furan-2-yl)-3,4-dihydro-1H-naphthalen-2-ol.

Molecular Properties

Compound Name6-bromo-2-(furan-2-yl)-3,4-dihydro-1H-naphthalen-2-ol
PubChem CID63948544
Molecular FormulaC14H13BrO2
Molecular Weight293.16 g/mol
Exact Mass292.01
IUPAC Name6-bromo-2-(furan-2-yl)-3,4-dihydro-1H-naphthalen-2-ol
SMILESOC1(c2ccco2)CCc2cc(Br)ccc2C1
InChIInChI=1S/C14H13BrO2/c15-12-4-3-11-9-14(16,6-5-10(11)8-12)13-2-1-7-17-13/h1-4,7-8,16H,5-6,9H2
InChIKeyZAQFHLUSTJMHQX-UHFFFAOYSA-N
XLogP3.42
TPSA33.37 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.16
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-bromo-2-(furan-2-yl)-3,4-dihydro-1H-naphthalen-2-ol?
The IUPAC name of 6-bromo-2-(furan-2-yl)-3,4-dihydro-1H-naphthalen-2-ol (CID 63948544) is 6-bromo-2-(furan-2-yl)-3,4-dihydro-1H-naphthalen-2-ol.
What is the SMILES notation for 6-bromo-2-(furan-2-yl)-3,4-dihydro-1H-naphthalen-2-ol?
The canonical SMILES for 6-bromo-2-(furan-2-yl)-3,4-dihydro-1H-naphthalen-2-ol is OC1(c2ccco2)CCc2cc(Br)ccc2C1.
What is the InChIKey of 6-bromo-2-(furan-2-yl)-3,4-dihydro-1H-naphthalen-2-ol?
The InChIKey is ZAQFHLUSTJMHQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13BrO2/c15-12-4-3-11-9-14(16,6-5-10(11)8-12)13-2-1-7-17-13/h1-4,7-8,16H,5-6,9H2.
What are the key properties of 6-bromo-2-(furan-2-yl)-3,4-dihydro-1H-naphthalen-2-ol?
6-bromo-2-(furan-2-yl)-3,4-dihydro-1H-naphthalen-2-ol has a molecular weight of 293.16 g/mol, XLogP of 3.42, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-2-(furan-2-yl)-3,4-dihydro-1H-naphthalen-2-ol is sourced from PubChem (CID 63948544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).