2-(5-chloro-2-fluorophenyl)-1-(2,3-dihydro-1H-inden-2-yl)ethanol

C17H16ClFO — CID 103048252

IUPAC2-(5-chloro-2-fluorophenyl)-1-(2,3-dihydro-1H-inden-2-yl)ethanol
SMILESOC(Cc1cc(Cl)ccc1F)C1Cc2ccccc2C1
InChIInChI=1S/C17H16ClFO/c18-15-5-6-16(19)13(9-15)10-17(20)14-7-11-3-1-2-4-12(11)8-14/h1-6,9,14,17,20H,7-8,10H2
InChIKeyDEQQGDZQTPOPLZ-UHFFFAOYSA-N
MW290.76 g/mol
LogP3.80
Rot. Bonds3

About 2-(5-chloro-2-fluorophenyl)-1-(2,3-dihydro-1H-inden-2-yl)ethanol

2-(5-chloro-2-fluorophenyl)-1-(2,3-dihydro-1H-inden-2-yl)ethanol (PubChem CID 103048252) has the molecular formula C17H16ClFO and a molecular weight of 290.76 g/mol. Its IUPAC name is 2-(5-chloro-2-fluorophenyl)-1-(2,3-dihydro-1H-inden-2-yl)ethanol.

Molecular Properties

Compound Name2-(5-chloro-2-fluorophenyl)-1-(2,3-dihydro-1H-inden-2-yl)ethanol
PubChem CID103048252
Molecular FormulaC17H16ClFO
Molecular Weight290.76 g/mol
Exact Mass290.09
IUPAC Name2-(5-chloro-2-fluorophenyl)-1-(2,3-dihydro-1H-inden-2-yl)ethanol
SMILESOC(Cc1cc(Cl)ccc1F)C1Cc2ccccc2C1
InChIInChI=1S/C17H16ClFO/c18-15-5-6-16(19)13(9-15)10-17(20)14-7-11-3-1-2-4-12(11)8-14/h1-6,9,14,17,20H,7-8,10H2
InChIKeyDEQQGDZQTPOPLZ-UHFFFAOYSA-N
XLogP3.80
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.76
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(5-chloro-2-fluorophenyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanol
CID 103048254
2-(2,5-dichlorophenyl)-1-(2,3-dihydro-1H-inden-2-yl)ethanol
CID 65411173
[2-(5-chloro-2-fluorophenyl)-1-(2,3-dihydro-1H-inden-2-yl)ethyl]hydrazine
CID 103053611
2-(2-chlorophenyl)-1-(2,3-dihydro-1H-inden-2-yl)ethanol
CID 65411952
2-(2-chloro-4-fluorophenyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanol
CID 65410795
2-(5-chloro-2-fluorophenyl)-1-(2,3-dihydro-1-benzothiophen-3-yl)ethanol
CID 103053466
2-(4-bromo-2-fluorophenyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanol
CID 65411188
2-(4-chloro-2-fluorophenyl)-1-cycloheptylethanol
CID 114852326
2-(4-fluoro-2-methylphenyl)-1-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanol
CID 114347478
2-(5-chloro-2-fluorophenyl)-1-[2-(trifluoromethyl)cyclohexyl]ethanol
CID 103053363
2-(5-chloro-2-fluorophenyl)-1-(2,3-dihydro-1H-indol-7-yl)ethanol
CID 103047776
1-cyclobutyl-2-(2,5-dichlorophenyl)ethanol
CID 65321223

Frequently Asked Questions

What is the IUPAC name of 2-(5-chloro-2-fluorophenyl)-1-(2,3-dihydro-1H-inden-2-yl)ethanol?
The IUPAC name of 2-(5-chloro-2-fluorophenyl)-1-(2,3-dihydro-1H-inden-2-yl)ethanol (CID 103048252) is 2-(5-chloro-2-fluorophenyl)-1-(2,3-dihydro-1H-inden-2-yl)ethanol.
What is the SMILES notation for 2-(5-chloro-2-fluorophenyl)-1-(2,3-dihydro-1H-inden-2-yl)ethanol?
The canonical SMILES for 2-(5-chloro-2-fluorophenyl)-1-(2,3-dihydro-1H-inden-2-yl)ethanol is OC(Cc1cc(Cl)ccc1F)C1Cc2ccccc2C1.
What is the InChIKey of 2-(5-chloro-2-fluorophenyl)-1-(2,3-dihydro-1H-inden-2-yl)ethanol?
The InChIKey is DEQQGDZQTPOPLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16ClFO/c18-15-5-6-16(19)13(9-15)10-17(20)14-7-11-3-1-2-4-12(11)8-14/h1-6,9,14,17,20H,7-8,10H2.
What are the key properties of 2-(5-chloro-2-fluorophenyl)-1-(2,3-dihydro-1H-inden-2-yl)ethanol?
2-(5-chloro-2-fluorophenyl)-1-(2,3-dihydro-1H-inden-2-yl)ethanol has a molecular weight of 290.76 g/mol, XLogP of 3.80, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-chloro-2-fluorophenyl)-1-(2,3-dihydro-1H-inden-2-yl)ethanol is sourced from PubChem (CID 103048252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).