3-(4-fluoro-2-methoxyphenyl)prop-2-en-1-ol

C10H11FO2 — CID 67414979

IUPAC3-(4-fluoro-2-methoxyphenyl)prop-2-en-1-ol
SMILESCOc1cc(F)ccc1C=CCO
InChIInChI=1S/C10H11FO2/c1-13-10-7-9(11)5-4-8(10)3-2-6-12/h2-5,7,12H,6H2,1H3
InChIKeyDQANUQIYEKSIHZ-UHFFFAOYSA-N
MW182.19 g/mol
LogP1.84
Rot. Bonds3

About 3-(4-fluoro-2-methoxyphenyl)prop-2-en-1-ol

3-(4-fluoro-2-methoxyphenyl)prop-2-en-1-ol (PubChem CID 67414979) has the molecular formula C10H11FO2 and a molecular weight of 182.19 g/mol. Its IUPAC name is 3-(4-fluoro-2-methoxyphenyl)prop-2-en-1-ol.

Molecular Properties

Compound Name3-(4-fluoro-2-methoxyphenyl)prop-2-en-1-ol
PubChem CID67414979
Molecular FormulaC10H11FO2
Molecular Weight182.19 g/mol
Exact Mass182.07
IUPAC Name3-(4-fluoro-2-methoxyphenyl)prop-2-en-1-ol
SMILESCOc1cc(F)ccc1C=CCO
InChIInChI=1S/C10H11FO2/c1-13-10-7-9(11)5-4-8(10)3-2-6-12/h2-5,7,12H,6H2,1H3
InChIKeyDQANUQIYEKSIHZ-UHFFFAOYSA-N
XLogP1.84
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.19
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(E)-3-(2-methoxyphenyl)prop-2-en-1-ol
CID 11400969
4-(4-fluoro-2-methoxyphenyl)-N-methylbut-3-en-1-amine
CID 170495635
5-[(E)-2-(4-fluoro-2-methoxyphenyl)ethenyl]-1,2,3-trimethoxybenzene
CID 175460433
4-fluoro-2-methoxybenzaldehyde
CID 2774537
4-(18F)fluoro-2-methoxy(18F)benzaldehyde
CID 14816736
5-fluoro-2-(3-hydroxyprop-1-enyl)benzaldehyde
CID 169453203
(E)-3-(2,3-dimethoxyphenyl)prop-2-en-1-ol
CID 67913122
(E)-3-(2,5-dimethoxy-4-methylphenyl)prop-2-en-1-ol
CID 10512550
(E)-3-(2-chloro-3,4-dimethoxyphenyl)prop-2-en-1-ol
CID 163198757
3-(5-amino-2-methoxyphenyl)prop-2-en-1-ol
CID 169453414
3-(4-methoxy-2-methylphenyl)prop-2-en-1-ol
CID 86025017
(Z)-2-fluoro-3-(4-fluoro-2-methoxyphenyl)prop-2-enoic acid
CID 155664666

Frequently Asked Questions

What is the IUPAC name of 3-(4-fluoro-2-methoxyphenyl)prop-2-en-1-ol?
The IUPAC name of 3-(4-fluoro-2-methoxyphenyl)prop-2-en-1-ol (CID 67414979) is 3-(4-fluoro-2-methoxyphenyl)prop-2-en-1-ol.
What is the SMILES notation for 3-(4-fluoro-2-methoxyphenyl)prop-2-en-1-ol?
The canonical SMILES for 3-(4-fluoro-2-methoxyphenyl)prop-2-en-1-ol is COc1cc(F)ccc1C=CCO.
What is the InChIKey of 3-(4-fluoro-2-methoxyphenyl)prop-2-en-1-ol?
The InChIKey is DQANUQIYEKSIHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11FO2/c1-13-10-7-9(11)5-4-8(10)3-2-6-12/h2-5,7,12H,6H2,1H3.
What are the key properties of 3-(4-fluoro-2-methoxyphenyl)prop-2-en-1-ol?
3-(4-fluoro-2-methoxyphenyl)prop-2-en-1-ol has a molecular weight of 182.19 g/mol, XLogP of 1.84, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-fluoro-2-methoxyphenyl)prop-2-en-1-ol is sourced from PubChem (CID 67414979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).