1-[(3-chloro-2-fluorophenyl)methyl]cyclopropan-1-ol

C10H10ClFO — CID 117289578

IUPAC1-[(3-chloro-2-fluorophenyl)methyl]cyclopropan-1-ol
SMILESOC1(Cc2cccc(Cl)c2F)CC1
InChIInChI=1S/C10H10ClFO/c11-8-3-1-2-7(9(8)12)6-10(13)4-5-10/h1-3,13H,4-6H2
InChIKeyZGCFWHGOUBKMLP-UHFFFAOYSA-N
MW200.64 g/mol
LogP2.55
Rot. Bonds2

About 1-[(3-chloro-2-fluorophenyl)methyl]cyclopropan-1-ol

1-[(3-chloro-2-fluorophenyl)methyl]cyclopropan-1-ol (PubChem CID 117289578) has the molecular formula C10H10ClFO and a molecular weight of 200.64 g/mol. Its IUPAC name is 1-[(3-chloro-2-fluorophenyl)methyl]cyclopropan-1-ol.

Molecular Properties

Compound Name1-[(3-chloro-2-fluorophenyl)methyl]cyclopropan-1-ol
PubChem CID117289578
Molecular FormulaC10H10ClFO
Molecular Weight200.64 g/mol
Exact Mass200.04
IUPAC Name1-[(3-chloro-2-fluorophenyl)methyl]cyclopropan-1-ol
SMILESOC1(Cc2cccc(Cl)c2F)CC1
InChIInChI=1S/C10H10ClFO/c11-8-3-1-2-7(9(8)12)6-10(13)4-5-10/h1-3,13H,4-6H2
InChIKeyZGCFWHGOUBKMLP-UHFFFAOYSA-N
XLogP2.55
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.64
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

8-[(3-chloro-2-fluorophenyl)methyl]spiro[4.5]decan-8-ol
CID 102857061
8-[(3-chloro-2-fluorophenyl)methyl]-1,4-dioxaspiro[4.5]decan-8-ol
CID 102856927
4-[(3-chloro-2-fluorophenyl)methyl]-4-hydroxycyclohexan-1-one
CID 102856928
1-[(3-chloro-2-fluorophenyl)methyl]-3,3-dimethylcyclohexan-1-ol
CID 102856900
[1-[(3-chloro-2-fluorophenyl)methyl]cyclopentyl]methanol
CID 102863615
[1-[(3-chloro-2-fluorophenyl)methyl]cyclohexyl]methanol
CID 102863614
3-[(3-chloro-2-fluorophenyl)methyl]-2-methyloxolan-3-ol
CID 102857011
[1-[(3-chloro-2-fluorophenyl)methyl]cyclobutyl]methanamine
CID 102858966
1-[(2-chlorophenyl)methyl]cycloheptan-1-ol
CID 60797945
1-[[1-(bromomethyl)cyclohexyl]methyl]-3-chloro-2-fluorobenzene
CID 102863764
2-(3-chloro-2-fluorophenyl)-1-(1-hydroxycyclopentyl)ethanone
CID 103447949
4-[(3-chloro-2-fluorophenyl)methyl]-1-azabicyclo[3.2.1]octan-4-ol
CID 102857072

Frequently Asked Questions

What is the IUPAC name of 1-[(3-chloro-2-fluorophenyl)methyl]cyclopropan-1-ol?
The IUPAC name of 1-[(3-chloro-2-fluorophenyl)methyl]cyclopropan-1-ol (CID 117289578) is 1-[(3-chloro-2-fluorophenyl)methyl]cyclopropan-1-ol.
What is the SMILES notation for 1-[(3-chloro-2-fluorophenyl)methyl]cyclopropan-1-ol?
The canonical SMILES for 1-[(3-chloro-2-fluorophenyl)methyl]cyclopropan-1-ol is OC1(Cc2cccc(Cl)c2F)CC1.
What is the InChIKey of 1-[(3-chloro-2-fluorophenyl)methyl]cyclopropan-1-ol?
The InChIKey is ZGCFWHGOUBKMLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10ClFO/c11-8-3-1-2-7(9(8)12)6-10(13)4-5-10/h1-3,13H,4-6H2.
What are the key properties of 1-[(3-chloro-2-fluorophenyl)methyl]cyclopropan-1-ol?
1-[(3-chloro-2-fluorophenyl)methyl]cyclopropan-1-ol has a molecular weight of 200.64 g/mol, XLogP of 2.55, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(3-chloro-2-fluorophenyl)methyl]cyclopropan-1-ol is sourced from PubChem (CID 117289578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).