2-(2,3-dichlorocyclopropyl)phenol

C9H8Cl2O — CID 69048040

IUPAC2-(2,3-dichlorocyclopropyl)phenol
SMILESOc1ccccc1C1C(Cl)C1Cl
InChIInChI=1S/C9H8Cl2O/c10-8-7(9(8)11)5-3-1-2-4-6(5)12/h1-4,7-9,12H
InChIKeyCNNALYATSZLFAI-UHFFFAOYSA-N
MW203.07 g/mol
LogP2.70
Rot. Bonds1

About 2-(2,3-dichlorocyclopropyl)phenol

2-(2,3-dichlorocyclopropyl)phenol (PubChem CID 69048040) has the molecular formula C9H8Cl2O and a molecular weight of 203.07 g/mol. Its IUPAC name is 2-(2,3-dichlorocyclopropyl)phenol.

Molecular Properties

Compound Name2-(2,3-dichlorocyclopropyl)phenol
PubChem CID69048040
Molecular FormulaC9H8Cl2O
Molecular Weight203.07 g/mol
Exact Mass202.00
IUPAC Name2-(2,3-dichlorocyclopropyl)phenol
SMILESOc1ccccc1C1C(Cl)C1Cl
InChIInChI=1S/C9H8Cl2O/c10-8-7(9(8)11)5-3-1-2-4-6(5)12/h1-4,7-9,12H
InChIKeyCNNALYATSZLFAI-UHFFFAOYSA-N
XLogP2.70
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.07
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

2-(2,3-dibromocyclopropyl)phenol
CID 21403439
(1S,3S)-2-chloro-2,3-dihydro-1H-indene-1,3-diol
CID 10511719
2-(dioxiran-3-yl)phenol
CID 87283547
heptacyclo[16.6.0.02,9.03,8.010,17.011,16.019,24]tetracosa-3,5,7,11,13,15,19,21,23-nonaene
CID 101073246
2-(2-chloro-1,3,2-dioxaphosphetan-4-yl)phenol
CID 141053024
(1R,2R,9S,10S,11S,12S)-11,12-dichlorotetracyclo[8.2.1.02,9.03,8]trideca-3,5,7-triene
CID 22216876
2-(oxaziridin-3-yl)phenol;trichlorochromium
CID 175156745
2-[(3S,4R)-1-benzyl-4-(2-hydroxyphenyl)pyrrolidin-3-yl]phenol
CID 70345589
nickel;2-(oxaziridin-3-yl)phenol
CID 174498524
2-cyclododecylphenol
CID 22381643
2-[(1S,2R)-2-methylcyclopropyl]phenol
CID 176896077
CID 6393025
CID 6393025

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dichlorocyclopropyl)phenol?
The IUPAC name of 2-(2,3-dichlorocyclopropyl)phenol (CID 69048040) is 2-(2,3-dichlorocyclopropyl)phenol.
What is the SMILES notation for 2-(2,3-dichlorocyclopropyl)phenol?
The canonical SMILES for 2-(2,3-dichlorocyclopropyl)phenol is Oc1ccccc1C1C(Cl)C1Cl.
What is the InChIKey of 2-(2,3-dichlorocyclopropyl)phenol?
The InChIKey is CNNALYATSZLFAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8Cl2O/c10-8-7(9(8)11)5-3-1-2-4-6(5)12/h1-4,7-9,12H.
What are the key properties of 2-(2,3-dichlorocyclopropyl)phenol?
2-(2,3-dichlorocyclopropyl)phenol has a molecular weight of 203.07 g/mol, XLogP of 2.70, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dichlorocyclopropyl)phenol is sourced from PubChem (CID 69048040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).