8-fluoro-6-(2-fluoro-4-propylphenyl)naphthalen-2-ol

C19H16F2O — CID 139849957

IUPAC8-fluoro-6-(2-fluoro-4-propylphenyl)naphthalen-2-ol
SMILESCCCc1ccc(-c2cc(F)c3cc(O)ccc3c2)c(F)c1
InChIInChI=1S/C19H16F2O/c1-2-3-12-4-7-16(18(20)8-12)14-9-13-5-6-15(22)11-17(13)19(21)10-14/h4-11,22H,2-3H2,1H3
InChIKeyLSQJAPDNNVVFLO-UHFFFAOYSA-N
MW298.33 g/mol
LogP5.44
Rot. Bonds3

About 8-fluoro-6-(2-fluoro-4-propylphenyl)naphthalen-2-ol

8-fluoro-6-(2-fluoro-4-propylphenyl)naphthalen-2-ol (PubChem CID 139849957) has the molecular formula C19H16F2O and a molecular weight of 298.33 g/mol. Its IUPAC name is 8-fluoro-6-(2-fluoro-4-propylphenyl)naphthalen-2-ol.

Molecular Properties

Compound Name8-fluoro-6-(2-fluoro-4-propylphenyl)naphthalen-2-ol
PubChem CID139849957
Molecular FormulaC19H16F2O
Molecular Weight298.33 g/mol
Exact Mass298.12
IUPAC Name8-fluoro-6-(2-fluoro-4-propylphenyl)naphthalen-2-ol
SMILESCCCc1ccc(-c2cc(F)c3cc(O)ccc3c2)c(F)c1
InChIInChI=1S/C19H16F2O/c1-2-3-12-4-7-16(18(20)8-12)14-9-13-5-6-15(22)11-17(13)19(21)10-14/h4-11,22H,2-3H2,1H3
InChIKeyLSQJAPDNNVVFLO-UHFFFAOYSA-N
XLogP5.44
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500298.33
LogP ≤ 55.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-(2-fluoro-4-propylphenyl)phenol
CID 139457311
6-(4-ethylphenyl)-8-fluoronaphthalen-2-ol
CID 139850074
6-[2,6-difluoro-4-(2-fluoro-4-propylphenyl)phenyl]-1,2-difluoronaphthalene
CID 139847336
2-[4-(2-fluoro-4-propylphenyl)phenyl]ethanol
CID 134432733
1-fluoro-3-propyl-7-(3,4,5-trifluorophenyl)naphthalene
CID 58761244
6-[4-(2,6-difluoro-4-propylphenyl)-2-fluorophenyl]-1,2-difluoronaphthalene
CID 139847195
1,2,3-trifluoro-5-[2-fluoro-4-[2-(2-fluoro-4-propylphenyl)ethyl]phenyl]benzene
CID 18513410
2-(2,2-difluoroethenyl)-6-(2-fluoro-4-propylphenyl)naphthalene
CID 139855803
1,3-difluoro-5-[2-fluoro-4-(4-propylphenyl)phenyl]-2-[(3,4,5-trifluorophenyl)methoxy]benzene
CID 90410644
6-[2,6-difluoro-4-(2-fluoro-4-propylphenyl)phenyl]-1-fluoro-2-(2,2,2-trifluoroethoxy)naphthalene
CID 139855641
ethane;6-propylnaphthalen-2-ol
CID 171088500
2-propyl-7-(3,4,5-trifluorophenyl)phenanthrene
CID 22044943

Frequently Asked Questions

What is the IUPAC name of 8-fluoro-6-(2-fluoro-4-propylphenyl)naphthalen-2-ol?
The IUPAC name of 8-fluoro-6-(2-fluoro-4-propylphenyl)naphthalen-2-ol (CID 139849957) is 8-fluoro-6-(2-fluoro-4-propylphenyl)naphthalen-2-ol.
What is the SMILES notation for 8-fluoro-6-(2-fluoro-4-propylphenyl)naphthalen-2-ol?
The canonical SMILES for 8-fluoro-6-(2-fluoro-4-propylphenyl)naphthalen-2-ol is CCCc1ccc(-c2cc(F)c3cc(O)ccc3c2)c(F)c1.
What is the InChIKey of 8-fluoro-6-(2-fluoro-4-propylphenyl)naphthalen-2-ol?
The InChIKey is LSQJAPDNNVVFLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16F2O/c1-2-3-12-4-7-16(18(20)8-12)14-9-13-5-6-15(22)11-17(13)19(21)10-14/h4-11,22H,2-3H2,1H3.
What are the key properties of 8-fluoro-6-(2-fluoro-4-propylphenyl)naphthalen-2-ol?
8-fluoro-6-(2-fluoro-4-propylphenyl)naphthalen-2-ol has a molecular weight of 298.33 g/mol, XLogP of 5.44, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-fluoro-6-(2-fluoro-4-propylphenyl)naphthalen-2-ol is sourced from PubChem (CID 139849957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).