(4-fluoro-2-prop-2-enoxyphenyl)methanol

C10H11FO2 — CID 67448374

IUPAC(4-fluoro-2-prop-2-enoxyphenyl)methanol
SMILESC=CCOc1cc(F)ccc1CO
InChIInChI=1S/C10H11FO2/c1-2-5-13-10-6-9(11)4-3-8(10)7-12/h2-4,6,12H,1,5,7H2
InChIKeyCQKMMNYHXVHBBY-UHFFFAOYSA-N
MW182.19 g/mol
LogP1.88
Rot. Bonds4

About (4-fluoro-2-prop-2-enoxyphenyl)methanol

(4-fluoro-2-prop-2-enoxyphenyl)methanol (PubChem CID 67448374) has the molecular formula C10H11FO2 and a molecular weight of 182.19 g/mol. Its IUPAC name is (4-fluoro-2-prop-2-enoxyphenyl)methanol.

Molecular Properties

Compound Name(4-fluoro-2-prop-2-enoxyphenyl)methanol
PubChem CID67448374
Molecular FormulaC10H11FO2
Molecular Weight182.19 g/mol
Exact Mass182.07
IUPAC Name(4-fluoro-2-prop-2-enoxyphenyl)methanol
SMILESC=CCOc1cc(F)ccc1CO
InChIInChI=1S/C10H11FO2/c1-2-5-13-10-6-9(11)4-3-8(10)7-12/h2-4,6,12H,1,5,7H2
InChIKeyCQKMMNYHXVHBBY-UHFFFAOYSA-N
XLogP1.88
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.19
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

(2-prop-2-enoxyphenyl)methanol
CID 11137475
[2,5-bis(hydroxymethyl)-4-prop-2-enoxyphenyl]methanol
CID 101326378
(4-fluoro-2-prop-2-enylphenyl)methanol
CID 118307113
(2-ethenyl-4-fluorophenyl)methanol
CID 118307012
(2-but-3-enyl-4-fluorophenyl)methanol
CID 118307025
5-fluoro-2-prop-2-enoxybenzoic acid
CID 63674181
3-prop-2-enoxy-4-prop-2-enylphenol
CID 14888956
4-ethyl-3-prop-2-enoxyphenol
CID 18512145
[3,4-bis(hydroxymethyl)-5-prop-2-enoxyphenyl]methanol
CID 101326376
N-[(2,5-difluorophenyl)methyl]-1-(2-prop-2-enoxyphenyl)methanamine
CID 63379238
1,2,4-trifluoro-5-prop-2-enoxybenzene
CID 130724512
methyl N-[1-(4-fluoro-2-prop-2-enoxyphenyl)prop-2-enyl]carbamate
CID 132581445

Frequently Asked Questions

What is the IUPAC name of (4-fluoro-2-prop-2-enoxyphenyl)methanol?
The IUPAC name of (4-fluoro-2-prop-2-enoxyphenyl)methanol (CID 67448374) is (4-fluoro-2-prop-2-enoxyphenyl)methanol.
What is the SMILES notation for (4-fluoro-2-prop-2-enoxyphenyl)methanol?
The canonical SMILES for (4-fluoro-2-prop-2-enoxyphenyl)methanol is C=CCOc1cc(F)ccc1CO.
What is the InChIKey of (4-fluoro-2-prop-2-enoxyphenyl)methanol?
The InChIKey is CQKMMNYHXVHBBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11FO2/c1-2-5-13-10-6-9(11)4-3-8(10)7-12/h2-4,6,12H,1,5,7H2.
What are the key properties of (4-fluoro-2-prop-2-enoxyphenyl)methanol?
(4-fluoro-2-prop-2-enoxyphenyl)methanol has a molecular weight of 182.19 g/mol, XLogP of 1.88, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-fluoro-2-prop-2-enoxyphenyl)methanol is sourced from PubChem (CID 67448374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).