3-[(2,3-dichlorophenyl)methyl]cyclopentan-1-ol

C12H14Cl2O — CID 107310340

IUPAC3-[(2,3-dichlorophenyl)methyl]cyclopentan-1-ol
SMILESOC1CCC(Cc2cccc(Cl)c2Cl)C1
InChIInChI=1S/C12H14Cl2O/c13-11-3-1-2-9(12(11)14)6-8-4-5-10(15)7-8/h1-3,8,10,15H,4-7H2
InChIKeyFRJPEEXTSKPORS-UHFFFAOYSA-N
MW245.15 g/mol
LogP3.70
Rot. Bonds2

About 3-[(2,3-dichlorophenyl)methyl]cyclopentan-1-ol

3-[(2,3-dichlorophenyl)methyl]cyclopentan-1-ol (PubChem CID 107310340) has the molecular formula C12H14Cl2O and a molecular weight of 245.15 g/mol. Its IUPAC name is 3-[(2,3-dichlorophenyl)methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name3-[(2,3-dichlorophenyl)methyl]cyclopentan-1-ol
PubChem CID107310340
Molecular FormulaC12H14Cl2O
Molecular Weight245.15 g/mol
Exact Mass244.04
IUPAC Name3-[(2,3-dichlorophenyl)methyl]cyclopentan-1-ol
SMILESOC1CCC(Cc2cccc(Cl)c2Cl)C1
InChIInChI=1S/C12H14Cl2O/c13-11-3-1-2-9(12(11)14)6-8-4-5-10(15)7-8/h1-3,8,10,15H,4-7H2
InChIKeyFRJPEEXTSKPORS-UHFFFAOYSA-N
XLogP3.70
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.15
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2,3-Dichlorophenyl)ethan-1-ol
CID 2734759
(1S)-1-(2,3-dichlorophenyl)ethan-1-ol
CID 103920518
2-(3,4-Dichlorophenyl)ethanol
CID 244558
1-(2,3-Dichlorophenyl)ethanol
CID 600228
2-(2-Chlorophenyl)cyclopentan-1-ol
CID 54593497
(1s,3s)-3-(3-Chlorophenyl)cyclobutan-1-ol
CID 60792575
2-(3-Chlorophenyl)cyclopentan-1-ol
CID 53621882
2-[(4-Chlorophenyl)methyl]cyclopentan-1-ol
CID 61749542
(1R,2S)-2-[(3-Chlorophenyl)methyl]cyclopentan-1-ol
CID 93964950
(1R)-1-(2,3-dichlorophenyl)ethan-1-ol
CID 103920516
2-[(2-Chlorophenyl)methyl]cyclopent-2-en-1-ol
CID 102519887
3-(3,4-Dichlorophenyl)-3-buten-1-ol
CID 9837316

Frequently Asked Questions

What is the IUPAC name of 3-[(2,3-dichlorophenyl)methyl]cyclopentan-1-ol?
The IUPAC name of 3-[(2,3-dichlorophenyl)methyl]cyclopentan-1-ol (CID 107310340) is 3-[(2,3-dichlorophenyl)methyl]cyclopentan-1-ol.
What is the SMILES notation for 3-[(2,3-dichlorophenyl)methyl]cyclopentan-1-ol?
The canonical SMILES for 3-[(2,3-dichlorophenyl)methyl]cyclopentan-1-ol is OC1CCC(Cc2cccc(Cl)c2Cl)C1.
What is the InChIKey of 3-[(2,3-dichlorophenyl)methyl]cyclopentan-1-ol?
The InChIKey is FRJPEEXTSKPORS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14Cl2O/c13-11-3-1-2-9(12(11)14)6-8-4-5-10(15)7-8/h1-3,8,10,15H,4-7H2.
What are the key properties of 3-[(2,3-dichlorophenyl)methyl]cyclopentan-1-ol?
3-[(2,3-dichlorophenyl)methyl]cyclopentan-1-ol has a molecular weight of 245.15 g/mol, XLogP of 3.70, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(2,3-dichlorophenyl)methyl]cyclopentan-1-ol is sourced from PubChem (CID 107310340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).