[8-(difluoromethyl)naphthalen-1-yl]methanol

C12H10F2O — CID 118847242

IUPAC[8-(difluoromethyl)naphthalen-1-yl]methanol
SMILESOCc1cccc2cccc(C(F)F)c12
InChIInChI=1S/C12H10F2O/c13-12(14)10-6-2-4-8-3-1-5-9(7-15)11(8)10/h1-6,12,15H,7H2
InChIKeyRKFCJUPIEYNOOY-UHFFFAOYSA-N
MW208.21 g/mol
LogP3.27
Rot. Bonds2

About [8-(difluoromethyl)naphthalen-1-yl]methanol

[8-(difluoromethyl)naphthalen-1-yl]methanol (PubChem CID 118847242) has the molecular formula C12H10F2O and a molecular weight of 208.21 g/mol. Its IUPAC name is [8-(difluoromethyl)naphthalen-1-yl]methanol.

Molecular Properties

Compound Name[8-(difluoromethyl)naphthalen-1-yl]methanol
PubChem CID118847242
Molecular FormulaC12H10F2O
Molecular Weight208.21 g/mol
Exact Mass208.07
IUPAC Name[8-(difluoromethyl)naphthalen-1-yl]methanol
SMILESOCc1cccc2cccc(C(F)F)c12
InChIInChI=1S/C12H10F2O/c13-12(14)10-6-2-4-8-3-1-5-9(7-15)11(8)10/h1-6,12,15H,7H2
InChIKeyRKFCJUPIEYNOOY-UHFFFAOYSA-N
XLogP3.27
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.21
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

[8-[8-(hydroxymethyl)naphthalen-1-yl]naphthalen-1-yl]methanol
CID 12507693
1-(difluoromethyl)-8-fluoronaphthalene
CID 118841607
(8-ethylnaphthalen-1-yl)methanol
CID 59514335
(8-aminonaphthalen-1-yl)methanol
CID 118807853
[7-(difluoromethyl)-1,3-benzoxazol-2-yl]methanol
CID 131092416
(8-pentylnaphthalen-1-yl)methanol
CID 101074092
N-[[8-(hydroxymethyl)naphthalen-1-yl]methyl]acetamide
CID 59694936
1-(1-bromoethyl)-8-ethylnaphthalene
CID 174593653
ethane-1,2-diol;perylene
CID 87614452
[2-(difluoromethyl)phenyl]methanamine
CID 71306246
2-[5-(2-hydroxyethyl)phenanthren-4-yl]ethanol
CID 87369855
[3-propan-2-yl-2-(trifluoromethyl)phenyl]methanol
CID 118269805

Frequently Asked Questions

What is the IUPAC name of [8-(difluoromethyl)naphthalen-1-yl]methanol?
The IUPAC name of [8-(difluoromethyl)naphthalen-1-yl]methanol (CID 118847242) is [8-(difluoromethyl)naphthalen-1-yl]methanol.
What is the SMILES notation for [8-(difluoromethyl)naphthalen-1-yl]methanol?
The canonical SMILES for [8-(difluoromethyl)naphthalen-1-yl]methanol is OCc1cccc2cccc(C(F)F)c12.
What is the InChIKey of [8-(difluoromethyl)naphthalen-1-yl]methanol?
The InChIKey is RKFCJUPIEYNOOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10F2O/c13-12(14)10-6-2-4-8-3-1-5-9(7-15)11(8)10/h1-6,12,15H,7H2.
What are the key properties of [8-(difluoromethyl)naphthalen-1-yl]methanol?
[8-(difluoromethyl)naphthalen-1-yl]methanol has a molecular weight of 208.21 g/mol, XLogP of 3.27, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [8-(difluoromethyl)naphthalen-1-yl]methanol is sourced from PubChem (CID 118847242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).