[3-fluoro-5-(5-fluoro-2-methylphenoxy)phenyl]methanol

C14H12F2O2 — CID 106530242

IUPAC[3-fluoro-5-(5-fluoro-2-methylphenoxy)phenyl]methanol
SMILESCc1ccc(F)cc1Oc1cc(F)cc(CO)c1
InChIInChI=1S/C14H12F2O2/c1-9-2-3-11(15)7-14(9)18-13-5-10(8-17)4-12(16)6-13/h2-7,17H,8H2,1H3
InChIKeyPRVVTPFQJMEIHS-UHFFFAOYSA-N
MW250.24 g/mol
LogP3.56
Rot. Bonds3

About [3-fluoro-5-(5-fluoro-2-methylphenoxy)phenyl]methanol

[3-fluoro-5-(5-fluoro-2-methylphenoxy)phenyl]methanol (PubChem CID 106530242) has the molecular formula C14H12F2O2 and a molecular weight of 250.24 g/mol. Its IUPAC name is [3-fluoro-5-(5-fluoro-2-methylphenoxy)phenyl]methanol.

Molecular Properties

Compound Name[3-fluoro-5-(5-fluoro-2-methylphenoxy)phenyl]methanol
PubChem CID106530242
Molecular FormulaC14H12F2O2
Molecular Weight250.24 g/mol
Exact Mass250.08
IUPAC Name[3-fluoro-5-(5-fluoro-2-methylphenoxy)phenyl]methanol
SMILESCc1ccc(F)cc1Oc1cc(F)cc(CO)c1
InChIInChI=1S/C14H12F2O2/c1-9-2-3-11(15)7-14(9)18-13-5-10(8-17)4-12(16)6-13/h2-7,17H,8H2,1H3
InChIKeyPRVVTPFQJMEIHS-UHFFFAOYSA-N
XLogP3.56
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.24
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(chloromethyl)-3-(2,5-dimethylphenoxy)-5-fluorobenzene
CID 106530613
[3-(2,3-difluorophenoxy)-5-fluorophenyl]methanol
CID 106530200
[3-(2-tert-butyl-4-methylphenoxy)-5-fluorophenyl]methanol
CID 106530108
[2-bromo-4-(5-fluoro-2-methylphenoxy)phenyl]methanol
CID 114060424
[3-(2-butan-2-ylphenoxy)-5-fluorophenyl]methanol
CID 106530139
[3-fluoro-5-(2,4,5-trichlorophenoxy)phenyl]methanol
CID 106530101
[3-(4-ethyl-2-methoxyphenoxy)-5-fluorophenyl]methanol
CID 107665951
(3-fluoro-5-methoxyphenyl)methanol
CID 26985456
1-[3-(2,5-difluorophenoxy)-5-fluorophenyl]-N-methylmethanamine
CID 106531306
[4-(3,5-difluorophenoxy)-3-fluorophenyl]methanol
CID 55112239
3-ethoxy-5-(5-fluoro-2-methylphenoxy)aniline
CID 102980299
[3-fluoro-5-[4-(2-methoxyethyl)phenoxy]phenyl]methanol
CID 106530155

Frequently Asked Questions

What is the IUPAC name of [3-fluoro-5-(5-fluoro-2-methylphenoxy)phenyl]methanol?
The IUPAC name of [3-fluoro-5-(5-fluoro-2-methylphenoxy)phenyl]methanol (CID 106530242) is [3-fluoro-5-(5-fluoro-2-methylphenoxy)phenyl]methanol.
What is the SMILES notation for [3-fluoro-5-(5-fluoro-2-methylphenoxy)phenyl]methanol?
The canonical SMILES for [3-fluoro-5-(5-fluoro-2-methylphenoxy)phenyl]methanol is Cc1ccc(F)cc1Oc1cc(F)cc(CO)c1.
What is the InChIKey of [3-fluoro-5-(5-fluoro-2-methylphenoxy)phenyl]methanol?
The InChIKey is PRVVTPFQJMEIHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12F2O2/c1-9-2-3-11(15)7-14(9)18-13-5-10(8-17)4-12(16)6-13/h2-7,17H,8H2,1H3.
What are the key properties of [3-fluoro-5-(5-fluoro-2-methylphenoxy)phenyl]methanol?
[3-fluoro-5-(5-fluoro-2-methylphenoxy)phenyl]methanol has a molecular weight of 250.24 g/mol, XLogP of 3.56, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [3-fluoro-5-(5-fluoro-2-methylphenoxy)phenyl]methanol is sourced from PubChem (CID 106530242), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).