(1R)-2,2,2-trifluoro-1-(2-methylnaphthalen-1-yl)ethanol

C13H11F3O — CID 14810052

IUPAC(1R)-2,2,2-trifluoro-1-(2-methylnaphthalen-1-yl)ethanol
SMILESCc1ccc2ccccc2c1[C@@H](O)C(F)(F)F
InChIInChI=1S/C13H11F3O/c1-8-6-7-9-4-2-3-5-10(9)11(8)12(17)13(14,15)16/h2-7,12,17H,1H3/t12-/m1/s1
InChIKeyBFUXWTYQATZUOI-GFCCVEGCSA-N
MW240.22 g/mol
LogP3.74
Rot. Bonds1

About (1R)-2,2,2-trifluoro-1-(2-methylnaphthalen-1-yl)ethanol

(1R)-2,2,2-trifluoro-1-(2-methylnaphthalen-1-yl)ethanol (PubChem CID 14810052) has the molecular formula C13H11F3O and a molecular weight of 240.22 g/mol. Its IUPAC name is (1R)-2,2,2-trifluoro-1-(2-methylnaphthalen-1-yl)ethanol.

Molecular Properties

Compound Name(1R)-2,2,2-trifluoro-1-(2-methylnaphthalen-1-yl)ethanol
PubChem CID14810052
Molecular FormulaC13H11F3O
Molecular Weight240.22 g/mol
Exact Mass240.08
IUPAC Name(1R)-2,2,2-trifluoro-1-(2-methylnaphthalen-1-yl)ethanol
SMILESCc1ccc2ccccc2c1[C@@H](O)C(F)(F)F
InChIInChI=1S/C13H11F3O/c1-8-6-7-9-4-2-3-5-10(9)11(8)12(17)13(14,15)16/h2-7,12,17H,1H3/t12-/m1/s1
InChIKeyBFUXWTYQATZUOI-GFCCVEGCSA-N
XLogP3.74
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.22
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2,2,3,3,3-pentafluoro-1-(2-methylnaphthalen-1-yl)propan-1-ol
CID 81431477
1-(1-chloro-4,4,4-trifluorobutyl)-2-methylnaphthalene
CID 81432520
1-(2-methylnaphthalen-1-yl)propan-1-ol
CID 80502673
2,3-dimethyl-1-(2-methylnaphthalen-1-yl)butan-1-ol
CID 81432516
ethane;2-methyl-1-propan-2-ylnaphthalene
CID 144871891
(2-methylnaphthalen-1-yl)-(1-methylpyrrol-2-yl)methanol
CID 91655781
2,2,3,3-tetrafluoro-N-methyl-1-(2-methylnaphthalen-1-yl)propan-1-amine
CID 81432025
(S)-(4-bromophenyl)-(2-methylnaphthalen-1-yl)methanol
CID 99714820
(2-methylnaphthalen-1-yl)-(5-methylthiophen-2-yl)methanol
CID 79020949
1-[1-bromo-2-(2-fluorophenyl)ethyl]-2-methylnaphthalene
CID 81430334
(R)-furan-3-yl-(2-methylnaphthalen-1-yl)methanol
CID 97056042
9-(1-deuteriooxy-2,2,2-trifluoroethyl)anthracene
CID 22850478

Frequently Asked Questions

What is the IUPAC name of (1R)-2,2,2-trifluoro-1-(2-methylnaphthalen-1-yl)ethanol?
The IUPAC name of (1R)-2,2,2-trifluoro-1-(2-methylnaphthalen-1-yl)ethanol (CID 14810052) is (1R)-2,2,2-trifluoro-1-(2-methylnaphthalen-1-yl)ethanol.
What is the SMILES notation for (1R)-2,2,2-trifluoro-1-(2-methylnaphthalen-1-yl)ethanol?
The canonical SMILES for (1R)-2,2,2-trifluoro-1-(2-methylnaphthalen-1-yl)ethanol is Cc1ccc2ccccc2c1[C@@H](O)C(F)(F)F.
What is the InChIKey of (1R)-2,2,2-trifluoro-1-(2-methylnaphthalen-1-yl)ethanol?
The InChIKey is BFUXWTYQATZUOI-GFCCVEGCSA-N. The full InChI is InChI=1S/C13H11F3O/c1-8-6-7-9-4-2-3-5-10(9)11(8)12(17)13(14,15)16/h2-7,12,17H,1H3/t12-/m1/s1.
What are the key properties of (1R)-2,2,2-trifluoro-1-(2-methylnaphthalen-1-yl)ethanol?
(1R)-2,2,2-trifluoro-1-(2-methylnaphthalen-1-yl)ethanol has a molecular weight of 240.22 g/mol, XLogP of 3.74, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-2,2,2-trifluoro-1-(2-methylnaphthalen-1-yl)ethanol is sourced from PubChem (CID 14810052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).