2-(2-fluoro-4-methylphenyl)propan-2-ol

C10H13FO — CID 58514695

IUPAC2-(2-fluoro-4-methylphenyl)propan-2-ol
SMILESCc1ccc(C(C)(C)O)c(F)c1
InChIInChI=1S/C10H13FO/c1-7-4-5-8(9(11)6-7)10(2,3)12/h4-6,12H,1-3H3
InChIKeyUHUAOBDQZHIJDA-UHFFFAOYSA-N
MW168.21 g/mol
LogP2.36
Rot. Bonds1

About 2-(2-fluoro-4-methylphenyl)propan-2-ol

2-(2-fluoro-4-methylphenyl)propan-2-ol (PubChem CID 58514695) has the molecular formula C10H13FO and a molecular weight of 168.21 g/mol. Its IUPAC name is 2-(2-fluoro-4-methylphenyl)propan-2-ol.

Molecular Properties

Compound Name2-(2-fluoro-4-methylphenyl)propan-2-ol
PubChem CID58514695
Molecular FormulaC10H13FO
Molecular Weight168.21 g/mol
Exact Mass168.10
IUPAC Name2-(2-fluoro-4-methylphenyl)propan-2-ol
SMILESCc1ccc(C(C)(C)O)c(F)c1
InChIInChI=1S/C10H13FO/c1-7-4-5-8(9(11)6-7)10(2,3)12/h4-6,12H,1-3H3
InChIKeyUHUAOBDQZHIJDA-UHFFFAOYSA-N
XLogP2.36
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.21
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

ethane;2-(2-fluoro-4-methylphenyl)propan-2-ol
CID 144773818
2-(4-amino-2-fluorophenyl)propan-2-ol
CID 122627261
(2S)-2-amino-2-(2-fluoro-4-methylphenyl)propan-1-ol
CID 55262273
ethene;2-fluoro-1,4-dimethylbenzene;2-methylpropan-2-ol
CID 145318169
2-(2-fluoro-4-methylphenyl)-N,2-dimethylpropan-1-amine
CID 83698847
1-[3-fluoro-4-(trifluoromethyl)phenyl]-1-(4-methylphenyl)ethanol
CID 107287051
1-(2,4-dimethylphenyl)-1-(2-fluorophenyl)ethanol
CID 55120280
4-(2-fluoro-4-methylphenyl)-2-methylbutan-2-ol
CID 142361288
(2-fluoro-4-methylphenyl)methanediol
CID 129136979
ethyl 2,2-difluoro-2-(2-fluoro-4-methylphenyl)acetate
CID 141413645
ethane;1-(2-fluoro-4-methylphenoxy)-2-methylpropan-2-ol
CID 145227313
1-(2-fluoro-5-methylphenyl)-2-methylpropan-2-ol
CID 142848449

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluoro-4-methylphenyl)propan-2-ol?
The IUPAC name of 2-(2-fluoro-4-methylphenyl)propan-2-ol (CID 58514695) is 2-(2-fluoro-4-methylphenyl)propan-2-ol.
What is the SMILES notation for 2-(2-fluoro-4-methylphenyl)propan-2-ol?
The canonical SMILES for 2-(2-fluoro-4-methylphenyl)propan-2-ol is Cc1ccc(C(C)(C)O)c(F)c1.
What is the InChIKey of 2-(2-fluoro-4-methylphenyl)propan-2-ol?
The InChIKey is UHUAOBDQZHIJDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13FO/c1-7-4-5-8(9(11)6-7)10(2,3)12/h4-6,12H,1-3H3.
What are the key properties of 2-(2-fluoro-4-methylphenyl)propan-2-ol?
2-(2-fluoro-4-methylphenyl)propan-2-ol has a molecular weight of 168.21 g/mol, XLogP of 2.36, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluoro-4-methylphenyl)propan-2-ol is sourced from PubChem (CID 58514695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).