(3-fluoro-5-propan-2-ylphenyl)methanol

C10H13FO — CID 59192640

IUPAC(3-fluoro-5-propan-2-ylphenyl)methanol
SMILESCC(C)c1cc(F)cc(CO)c1
InChIInChI=1S/C10H13FO/c1-7(2)9-3-8(6-12)4-10(11)5-9/h3-5,7,12H,6H2,1-2H3
InChIKeyMZXKQGLJHBVZFI-UHFFFAOYSA-N
MW168.21 g/mol
LogP2.44
Rot. Bonds2

About (3-fluoro-5-propan-2-ylphenyl)methanol

(3-fluoro-5-propan-2-ylphenyl)methanol (PubChem CID 59192640) has the molecular formula C10H13FO and a molecular weight of 168.21 g/mol. Its IUPAC name is (3-fluoro-5-propan-2-ylphenyl)methanol.

Molecular Properties

Compound Name(3-fluoro-5-propan-2-ylphenyl)methanol
PubChem CID59192640
Molecular FormulaC10H13FO
Molecular Weight168.21 g/mol
Exact Mass168.10
IUPAC Name(3-fluoro-5-propan-2-ylphenyl)methanol
SMILESCC(C)c1cc(F)cc(CO)c1
InChIInChI=1S/C10H13FO/c1-7(2)9-3-8(6-12)4-10(11)5-9/h3-5,7,12H,6H2,1-2H3
InChIKeyMZXKQGLJHBVZFI-UHFFFAOYSA-N
XLogP2.44
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.21
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

[3-(hydroxymethyl)-5-propan-2-ylphenyl]methanol
CID 122692713
1-(3-fluoro-5-propan-2-ylphenyl)-3-methylbutan-2-ol
CID 130224243
2-(3-fluoro-5-propan-2-ylphenyl)acetonitrile
CID 84767390
3-(3-fluoro-5-propan-2-ylphenyl)propanal
CID 117284667
[3-fluoro-5-[(1S,2R)-1,2,3-trimethoxypropyl]phenyl]methanol
CID 22855754
(3-propan-2-yl-5-propan-2-ylsulfanylphenyl)methanol
CID 176584231
[3-[butan-2-yl(ethyl)amino]-5-fluorophenyl]methanol
CID 106529699
3-amino-3-(3-fluoro-5-propan-2-ylphenyl)propan-1-ol
CID 84781818
1-(difluoromethyl)-3-fluoro-5-propan-2-ylbenzene
CID 118404669
[3-[1-[3,5-bis(hydroxymethyl)phenyl]ethyl]-5-(hydroxymethyl)phenyl]methanol;ethane
CID 142281106
N-[4-[3-fluoro-5-(hydroxymethyl)phenyl]-3,4-dihydroxybutyl]acetamide
CID 171882969
[3-[butan-2-yl(methyl)amino]-5-fluorophenyl]methanol
CID 106529697

Frequently Asked Questions

What is the IUPAC name of (3-fluoro-5-propan-2-ylphenyl)methanol?
The IUPAC name of (3-fluoro-5-propan-2-ylphenyl)methanol (CID 59192640) is (3-fluoro-5-propan-2-ylphenyl)methanol.
What is the SMILES notation for (3-fluoro-5-propan-2-ylphenyl)methanol?
The canonical SMILES for (3-fluoro-5-propan-2-ylphenyl)methanol is CC(C)c1cc(F)cc(CO)c1.
What is the InChIKey of (3-fluoro-5-propan-2-ylphenyl)methanol?
The InChIKey is MZXKQGLJHBVZFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13FO/c1-7(2)9-3-8(6-12)4-10(11)5-9/h3-5,7,12H,6H2,1-2H3.
What are the key properties of (3-fluoro-5-propan-2-ylphenyl)methanol?
(3-fluoro-5-propan-2-ylphenyl)methanol has a molecular weight of 168.21 g/mol, XLogP of 2.44, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3-fluoro-5-propan-2-ylphenyl)methanol is sourced from PubChem (CID 59192640), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).