2-fluoro-2-(4-methoxy-2-methylphenyl)ethanol

C10H13FO2 — CID 105426307

IUPAC2-fluoro-2-(4-methoxy-2-methylphenyl)ethanol
SMILESCOc1ccc(C(F)CO)c(C)c1
InChIInChI=1S/C10H13FO2/c1-7-5-8(13-2)3-4-9(7)10(11)6-12/h3-5,10,12H,6H2,1-2H3
InChIKeyGZHWELFIVPXSQF-UHFFFAOYSA-N
MW184.21 g/mol
LogP2.01
Rot. Bonds3

About 2-fluoro-2-(4-methoxy-2-methylphenyl)ethanol

2-fluoro-2-(4-methoxy-2-methylphenyl)ethanol (PubChem CID 105426307) has the molecular formula C10H13FO2 and a molecular weight of 184.21 g/mol. Its IUPAC name is 2-fluoro-2-(4-methoxy-2-methylphenyl)ethanol.

Molecular Properties

Compound Name2-fluoro-2-(4-methoxy-2-methylphenyl)ethanol
PubChem CID105426307
Molecular FormulaC10H13FO2
Molecular Weight184.21 g/mol
Exact Mass184.09
IUPAC Name2-fluoro-2-(4-methoxy-2-methylphenyl)ethanol
SMILESCOc1ccc(C(F)CO)c(C)c1
InChIInChI=1S/C10H13FO2/c1-7-5-8(13-2)3-4-9(7)10(11)6-12/h3-5,10,12H,6H2,1-2H3
InChIKeyGZHWELFIVPXSQF-UHFFFAOYSA-N
XLogP2.01
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.21
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-fluoro-2-(4-methoxy-2-methylphenyl)-N-methylethanamine
CID 105426266
2-(4,5-dimethoxy-2-methylphenyl)-2-fluoroethanol
CID 105424343
1-(4-methoxy-2-methylphenyl)propan-1-ol
CID 13147116
(1R,2S)-1-amino-1-(4-methoxy-2-methylphenyl)butan-2-ol
CID 171265166
3,3,3-trifluoro-1-(4-methoxy-2-methylphenyl)propan-1-ol
CID 61101293
ethyl (3S)-3-amino-2-fluoro-3-(4-methoxy-2-methylphenyl)propanoate
CID 171250977
(2R)-2-fluoro-2-(4-methoxyphenyl)ethanol
CID 130626363
ethyl (3R)-3-amino-2-fluoro-3-(4-methoxy-2-methylphenyl)propanoate;hydrochloride
CID 171244245
(4R)-4-amino-4-(4-methoxy-2-methylphenyl)butan-1-ol;hydrochloride
CID 171213822
2,2-dichloro-1-(4-methoxy-2-methylphenyl)ethanol
CID 164892247
1-(1-bromopropyl)-4-methoxy-2-methylbenzene
CID 61097886
[4-(difluoromethoxy)phenyl]-(4-methoxy-2-methylphenyl)methanol
CID 61101461

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-2-(4-methoxy-2-methylphenyl)ethanol?
The IUPAC name of 2-fluoro-2-(4-methoxy-2-methylphenyl)ethanol (CID 105426307) is 2-fluoro-2-(4-methoxy-2-methylphenyl)ethanol.
What is the SMILES notation for 2-fluoro-2-(4-methoxy-2-methylphenyl)ethanol?
The canonical SMILES for 2-fluoro-2-(4-methoxy-2-methylphenyl)ethanol is COc1ccc(C(F)CO)c(C)c1.
What is the InChIKey of 2-fluoro-2-(4-methoxy-2-methylphenyl)ethanol?
The InChIKey is GZHWELFIVPXSQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13FO2/c1-7-5-8(13-2)3-4-9(7)10(11)6-12/h3-5,10,12H,6H2,1-2H3.
What are the key properties of 2-fluoro-2-(4-methoxy-2-methylphenyl)ethanol?
2-fluoro-2-(4-methoxy-2-methylphenyl)ethanol has a molecular weight of 184.21 g/mol, XLogP of 2.01, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-2-(4-methoxy-2-methylphenyl)ethanol is sourced from PubChem (CID 105426307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).