(3-fluoro-4-propan-2-yloxyphenyl)methanol

C10H13FO2 — CID 28945931

IUPAC(3-fluoro-4-propan-2-yloxyphenyl)methanol
SMILESCC(C)Oc1ccc(CO)cc1F
InChIInChI=1S/C10H13FO2/c1-7(2)13-10-4-3-8(6-12)5-9(10)11/h3-5,7,12H,6H2,1-2H3
InChIKeyPDXAJVJNHNRBFY-UHFFFAOYSA-N
MW184.21 g/mol
LogP2.11
Rot. Bonds3

About (3-fluoro-4-propan-2-yloxyphenyl)methanol

(3-fluoro-4-propan-2-yloxyphenyl)methanol (PubChem CID 28945931) has the molecular formula C10H13FO2 and a molecular weight of 184.21 g/mol. Its IUPAC name is (3-fluoro-4-propan-2-yloxyphenyl)methanol.

Molecular Properties

Compound Name(3-fluoro-4-propan-2-yloxyphenyl)methanol
PubChem CID28945931
Molecular FormulaC10H13FO2
Molecular Weight184.21 g/mol
Exact Mass184.09
IUPAC Name(3-fluoro-4-propan-2-yloxyphenyl)methanol
SMILESCC(C)Oc1ccc(CO)cc1F
InChIInChI=1S/C10H13FO2/c1-7(2)13-10-4-3-8(6-12)5-9(10)11/h3-5,7,12H,6H2,1-2H3
InChIKeyPDXAJVJNHNRBFY-UHFFFAOYSA-N
XLogP2.11
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 ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-[2-fluoro-4-(hydroxymethyl)phenoxy]propanenitrile
CID 107690970
2-[2-fluoro-4-(hydroxymethyl)phenoxy]-N-(2-methylpropyl)propanamide
CID 107690685
2-[2-fluoro-4-(hydroxymethyl)phenoxy]-N-(3-methylbutyl)propanamide
CID 107690610
N-[2-(3-fluoro-4-propan-2-yloxyphenyl)ethyl]acetamide
CID 110788935
2-[(3-fluoro-4-propan-2-yloxyphenyl)methylamino]acetic acid
CID 98784176
N-[(3-fluoro-4-propan-2-yloxyphenyl)methyl]-3-methylbutanamide
CID 110782111
[4-propan-2-yloxy-3-[(Z)-prop-1-enyl]phenyl]methanol
CID 177450686
(3-nitro-4-propan-2-yloxyphenyl)methanol
CID 28963964
[3-fluoro-4-(2-methyl-5-propan-2-ylphenoxy)phenyl]methanol
CID 63540052
[4-(ethoxymethoxy)-3-fluorophenyl]methanol
CID 107690890
3-fluoro-4-propan-2-yloxybenzenesulfonic acid
CID 82475780
[4-(3,5-difluorophenoxy)-3-fluorophenyl]methanol
CID 55112239

Frequently Asked Questions

What is the IUPAC name of (3-fluoro-4-propan-2-yloxyphenyl)methanol?
The IUPAC name of (3-fluoro-4-propan-2-yloxyphenyl)methanol (CID 28945931) is (3-fluoro-4-propan-2-yloxyphenyl)methanol.
What is the SMILES notation for (3-fluoro-4-propan-2-yloxyphenyl)methanol?
The canonical SMILES for (3-fluoro-4-propan-2-yloxyphenyl)methanol is CC(C)Oc1ccc(CO)cc1F.
What is the InChIKey of (3-fluoro-4-propan-2-yloxyphenyl)methanol?
The InChIKey is PDXAJVJNHNRBFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13FO2/c1-7(2)13-10-4-3-8(6-12)5-9(10)11/h3-5,7,12H,6H2,1-2H3.
What are the key properties of (3-fluoro-4-propan-2-yloxyphenyl)methanol?
(3-fluoro-4-propan-2-yloxyphenyl)methanol has a molecular weight of 184.21 g/mol, XLogP of 2.11, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-fluoro-4-propan-2-yloxyphenyl)methanol is sourced from PubChem (CID 28945931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).