2-chloro-6-(1-methylcyclopropyl)phenol

C10H11ClO — CID 174458816

IUPAC2-chloro-6-(1-methylcyclopropyl)phenol
SMILESCC1(c2cccc(Cl)c2O)CC1
InChIInChI=1S/C10H11ClO/c1-10(5-6-10)7-3-2-4-8(11)9(7)12/h2-4,12H,5-6H2,1H3
InChIKeyAUWULDFPPGFWFW-UHFFFAOYSA-N
MW182.65 g/mol
LogP3.10
Rot. Bonds1

About 2-chloro-6-(1-methylcyclopropyl)phenol

2-chloro-6-(1-methylcyclopropyl)phenol (PubChem CID 174458816) has the molecular formula C10H11ClO and a molecular weight of 182.65 g/mol. Its IUPAC name is 2-chloro-6-(1-methylcyclopropyl)phenol.

Molecular Properties

Compound Name2-chloro-6-(1-methylcyclopropyl)phenol
PubChem CID174458816
Molecular FormulaC10H11ClO
Molecular Weight182.65 g/mol
Exact Mass182.05
IUPAC Name2-chloro-6-(1-methylcyclopropyl)phenol
SMILESCC1(c2cccc(Cl)c2O)CC1
InChIInChI=1S/C10H11ClO/c1-10(5-6-10)7-3-2-4-8(11)9(7)12/h2-4,12H,5-6H2,1H3
InChIKeyAUWULDFPPGFWFW-UHFFFAOYSA-N
XLogP3.10
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.65
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-(1-methylcyclopropyl)phenol?
The IUPAC name of 2-chloro-6-(1-methylcyclopropyl)phenol (CID 174458816) is 2-chloro-6-(1-methylcyclopropyl)phenol.
What is the SMILES notation for 2-chloro-6-(1-methylcyclopropyl)phenol?
The canonical SMILES for 2-chloro-6-(1-methylcyclopropyl)phenol is CC1(c2cccc(Cl)c2O)CC1.
What is the InChIKey of 2-chloro-6-(1-methylcyclopropyl)phenol?
The InChIKey is AUWULDFPPGFWFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11ClO/c1-10(5-6-10)7-3-2-4-8(11)9(7)12/h2-4,12H,5-6H2,1H3.
What are the key properties of 2-chloro-6-(1-methylcyclopropyl)phenol?
2-chloro-6-(1-methylcyclopropyl)phenol has a molecular weight of 182.65 g/mol, XLogP of 3.10, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-(1-methylcyclopropyl)phenol is sourced from PubChem (CID 174458816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).