9-but-2-ynylfluoren-9-ol

C17H14O — CID 155470796

IUPAC9-but-2-ynylfluoren-9-ol
SMILESCC#CCC1(O)c2ccccc2-c2ccccc21
InChIInChI=1S/C17H14O/c1-2-3-12-17(18)15-10-6-4-8-13(15)14-9-5-7-11-16(14)17/h4-11,18H,12H2,1H3
InChIKeyFQUGJCRQRKXAFA-UHFFFAOYSA-N
MW234.30 g/mol
LogP3.32
Rot. Bonds1

About 9-but-2-ynylfluoren-9-ol

9-but-2-ynylfluoren-9-ol (PubChem CID 155470796) has the molecular formula C17H14O and a molecular weight of 234.30 g/mol. Its IUPAC name is 9-but-2-ynylfluoren-9-ol.

Molecular Properties

Compound Name9-but-2-ynylfluoren-9-ol
PubChem CID155470796
Molecular FormulaC17H14O
Molecular Weight234.30 g/mol
Exact Mass234.10
IUPAC Name9-but-2-ynylfluoren-9-ol
SMILESCC#CCC1(O)c2ccccc2-c2ccccc21
InChIInChI=1S/C17H14O/c1-2-3-12-17(18)15-10-6-4-8-13(15)14-9-5-7-11-16(14)17/h4-11,18H,12H2,1H3
InChIKeyFQUGJCRQRKXAFA-UHFFFAOYSA-N
XLogP3.32
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 53.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triple_bond', 'substructure': 'N/A'}

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Related Compounds

9-[4-[di(propan-2-yl)amino]but-2-ynyl]fluoren-9-ol chloride
CID 53347287
9-(iodomethyl)fluoren-9-ol
CID 135158118
9-(methylaminomethyl)fluoren-9-ol
CID 132915706
methane;9-methylfluoren-9-ol
CID 160708378
2-(9-hydroxyfluoren-9-yl)propanenitrile
CID 21161844
8-hydroxy-8-prop-1-ynylbicyclo[4.2.0]octa-1,3,5-trien-7-one
CID 14813467
9-[2-(9H-fluoren-9-yl)ethyl]-9H-fluorene;9-[2-(9-hydroxyfluoren-9-yl)ethyl]fluoren-9-ol
CID 161282219
9-prop-1-ynyl-9-[4-[4-(9-prop-1-ynylfluoren-9-yl)phenyl]phenyl]fluorene
CID 153299320
9-methyl-9-prop-1-en-2-ylfluorene
CID 10911089
9-[4-[(1R,2S)-1-methyl-2-(1-methylpyridin-1-ium-3-yl)piperidin-1-ium-1-yl]but-2-ynyl]fluoren-9-ol
CID 2007912
9-(2-bromoethynyl)fluoren-9-ol
CID 10968066
7-prop-1-ynylbenzo[c]fluoren-7-ol
CID 164808851

Frequently Asked Questions

What is the IUPAC name of 9-but-2-ynylfluoren-9-ol?
The IUPAC name of 9-but-2-ynylfluoren-9-ol (CID 155470796) is 9-but-2-ynylfluoren-9-ol.
What is the SMILES notation for 9-but-2-ynylfluoren-9-ol?
The canonical SMILES for 9-but-2-ynylfluoren-9-ol is CC#CCC1(O)c2ccccc2-c2ccccc21.
What is the InChIKey of 9-but-2-ynylfluoren-9-ol?
The InChIKey is FQUGJCRQRKXAFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14O/c1-2-3-12-17(18)15-10-6-4-8-13(15)14-9-5-7-11-16(14)17/h4-11,18H,12H2,1H3.
What are the key properties of 9-but-2-ynylfluoren-9-ol?
9-but-2-ynylfluoren-9-ol has a molecular weight of 234.30 g/mol, XLogP of 3.32, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 9-but-2-ynylfluoren-9-ol is sourced from PubChem (CID 155470796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).