1-(2-chloro-4-fluorophenyl)-2-ethylcyclopropan-1-ol

C11H12ClFO — CID 79333044

IUPAC1-(2-chloro-4-fluorophenyl)-2-ethylcyclopropan-1-ol
SMILESCCC1CC1(O)c1ccc(F)cc1Cl
InChIInChI=1S/C11H12ClFO/c1-2-7-6-11(7,14)9-4-3-8(13)5-10(9)12/h3-5,7,14H,2,6H2,1H3
InChIKeyWJKCHADDAOHIRG-UHFFFAOYSA-N
MW214.67 g/mol
LogP3.10
Rot. Bonds2

About 1-(2-chloro-4-fluorophenyl)-2-ethylcyclopropan-1-ol

1-(2-chloro-4-fluorophenyl)-2-ethylcyclopropan-1-ol (PubChem CID 79333044) has the molecular formula C11H12ClFO and a molecular weight of 214.67 g/mol. Its IUPAC name is 1-(2-chloro-4-fluorophenyl)-2-ethylcyclopropan-1-ol.

Molecular Properties

Compound Name1-(2-chloro-4-fluorophenyl)-2-ethylcyclopropan-1-ol
PubChem CID79333044
Molecular FormulaC11H12ClFO
Molecular Weight214.67 g/mol
Exact Mass214.06
IUPAC Name1-(2-chloro-4-fluorophenyl)-2-ethylcyclopropan-1-ol
SMILESCCC1CC1(O)c1ccc(F)cc1Cl
InChIInChI=1S/C11H12ClFO/c1-2-7-6-11(7,14)9-4-3-8(13)5-10(9)12/h3-5,7,14H,2,6H2,1H3
InChIKeyWJKCHADDAOHIRG-UHFFFAOYSA-N
XLogP3.10
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.67
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2,4-dimethylphenyl)-2-ethylcyclopropan-1-ol
CID 79332918
[(2R)-2-(aminomethyl)-2-(2-chloro-4-fluorophenyl)cyclopropyl]methanol
CID 135193000
1-(2-chlorophenyl)-2-propylcyclopropan-1-ol
CID 79332474
1-(1,2-diethylcyclopropyl)-2,4-difluorobenzene
CID 135292727
1-(4-bromo-3-fluorophenyl)-2-ethylcyclopropan-1-ol
CID 79333273
1-(2-bromo-4-fluorophenyl)-2-ethylcyclopropan-1-amine
CID 107281655
[1-(2-chloro-4-fluorophenyl)cyclobutyl]methanol
CID 131026964
N-[[1-(2-chloro-4-fluorophenyl)-3-ethylcyclobutyl]methyl]-2-methoxyethanamine
CID 64999342
2-[[1-(2-chloro-4-fluorophenyl)cyclopropyl]methyl]-1-cyclopropyl-1-methylguanidine;hydroiodide
CID 110031853
1-(3-chloro-5-methylphenyl)-2-ethylcyclopropan-1-ol
CID 81324159
1-[1-(2-chloro-4-fluorophenyl)-3-propan-2-ylcyclobutyl]-N-methylmethanamine
CID 65016900
1-(3-bromo-5-chlorophenyl)-2-ethylcyclopropan-1-ol
CID 107957835

Frequently Asked Questions

What is the IUPAC name of 1-(2-chloro-4-fluorophenyl)-2-ethylcyclopropan-1-ol?
The IUPAC name of 1-(2-chloro-4-fluorophenyl)-2-ethylcyclopropan-1-ol (CID 79333044) is 1-(2-chloro-4-fluorophenyl)-2-ethylcyclopropan-1-ol.
What is the SMILES notation for 1-(2-chloro-4-fluorophenyl)-2-ethylcyclopropan-1-ol?
The canonical SMILES for 1-(2-chloro-4-fluorophenyl)-2-ethylcyclopropan-1-ol is CCC1CC1(O)c1ccc(F)cc1Cl.
What is the InChIKey of 1-(2-chloro-4-fluorophenyl)-2-ethylcyclopropan-1-ol?
The InChIKey is WJKCHADDAOHIRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12ClFO/c1-2-7-6-11(7,14)9-4-3-8(13)5-10(9)12/h3-5,7,14H,2,6H2,1H3.
What are the key properties of 1-(2-chloro-4-fluorophenyl)-2-ethylcyclopropan-1-ol?
1-(2-chloro-4-fluorophenyl)-2-ethylcyclopropan-1-ol has a molecular weight of 214.67 g/mol, XLogP of 3.10, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chloro-4-fluorophenyl)-2-ethylcyclopropan-1-ol is sourced from PubChem (CID 79333044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).