6-(2,3-dichlorophenyl)bicyclo[3.1.0]hexan-6-ol

C12H12Cl2O — CID 79330835

IUPAC6-(2,3-dichlorophenyl)bicyclo[3.1.0]hexan-6-ol
SMILESOC1(c2cccc(Cl)c2Cl)C2CCCC21
InChIInChI=1S/C12H12Cl2O/c13-10-6-2-5-9(11(10)14)12(15)7-3-1-4-8(7)12/h2,5-8,15H,1,3-4H2
InChIKeyLFBSDCMWILLFGK-UHFFFAOYSA-N
MW243.13 g/mol
LogP3.61
Rot. Bonds1

About 6-(2,3-dichlorophenyl)bicyclo[3.1.0]hexan-6-ol

6-(2,3-dichlorophenyl)bicyclo[3.1.0]hexan-6-ol (PubChem CID 79330835) has the molecular formula C12H12Cl2O and a molecular weight of 243.13 g/mol. Its IUPAC name is 6-(2,3-dichlorophenyl)bicyclo[3.1.0]hexan-6-ol.

Molecular Properties

Compound Name6-(2,3-dichlorophenyl)bicyclo[3.1.0]hexan-6-ol
PubChem CID79330835
Molecular FormulaC12H12Cl2O
Molecular Weight243.13 g/mol
Exact Mass242.03
IUPAC Name6-(2,3-dichlorophenyl)bicyclo[3.1.0]hexan-6-ol
SMILESOC1(c2cccc(Cl)c2Cl)C2CCCC21
InChIInChI=1S/C12H12Cl2O/c13-10-6-2-5-9(11(10)14)12(15)7-3-1-4-8(7)12/h2,5-8,15H,1,3-4H2
InChIKeyLFBSDCMWILLFGK-UHFFFAOYSA-N
XLogP3.61
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.13
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

6-(2-chloro-6-fluorophenyl)bicyclo[3.1.0]hexan-6-ol
CID 79330942
(1R,5S)-3-(2,3-dichlorophenyl)-8-azabicyclo[3.2.1]octan-3-ol
CID 25132531
1-(2,3-dichlorophenyl)-3-(trifluoromethyl)cyclohexan-1-ol
CID 64757033
3-(2,3-dichlorophenyl)-5,5-dimethylthian-3-ol
CID 79946366
1-(2,3-dichlorophenyl)cyclopentan-1-amine
CID 62788667
7-(2,3-dimethoxyphenyl)bicyclo[4.1.0]heptan-7-ol
CID 79331887
2-(2,3-dichlorophenoxy)cyclopentan-1-ol
CID 60878793
1-(2,3-dichlorophenyl)-4-methylcyclohexan-1-amine
CID 62788342
6-(2,3,4-trifluorophenyl)bicyclo[3.1.0]hexan-6-ol
CID 79755983
1-cyclobutyl-2-(2,3-dichlorophenyl)ethanone
CID 107307888
cyclobutyl-(2,3-dichlorophenyl)methanol
CID 64986948
1-(2,3-dichlorophenyl)-2,3,4,5,6,7,8,8a-octahydro-1H-isoquinolin-4a-ol
CID 6456030

Frequently Asked Questions

What is the IUPAC name of 6-(2,3-dichlorophenyl)bicyclo[3.1.0]hexan-6-ol?
The IUPAC name of 6-(2,3-dichlorophenyl)bicyclo[3.1.0]hexan-6-ol (CID 79330835) is 6-(2,3-dichlorophenyl)bicyclo[3.1.0]hexan-6-ol.
What is the SMILES notation for 6-(2,3-dichlorophenyl)bicyclo[3.1.0]hexan-6-ol?
The canonical SMILES for 6-(2,3-dichlorophenyl)bicyclo[3.1.0]hexan-6-ol is OC1(c2cccc(Cl)c2Cl)C2CCCC21.
What is the InChIKey of 6-(2,3-dichlorophenyl)bicyclo[3.1.0]hexan-6-ol?
The InChIKey is LFBSDCMWILLFGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12Cl2O/c13-10-6-2-5-9(11(10)14)12(15)7-3-1-4-8(7)12/h2,5-8,15H,1,3-4H2.
What are the key properties of 6-(2,3-dichlorophenyl)bicyclo[3.1.0]hexan-6-ol?
6-(2,3-dichlorophenyl)bicyclo[3.1.0]hexan-6-ol has a molecular weight of 243.13 g/mol, XLogP of 3.61, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,3-dichlorophenyl)bicyclo[3.1.0]hexan-6-ol is sourced from PubChem (CID 79330835), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).