3-chloro-2-(2-methylcyclopropyl)phenol

C10H11ClO — CID 89070778

IUPAC3-chloro-2-(2-methylcyclopropyl)phenol
SMILESCC1CC1c1c(O)cccc1Cl
InChIInChI=1S/C10H11ClO/c1-6-5-7(6)10-8(11)3-2-4-9(10)12/h2-4,6-7,12H,5H2,1H3
InChIKeyFRWAVCMHGRQBJM-UHFFFAOYSA-N
MW182.65 g/mol
LogP3.17
Rot. Bonds1

About 3-chloro-2-(2-methylcyclopropyl)phenol

3-chloro-2-(2-methylcyclopropyl)phenol (PubChem CID 89070778) has the molecular formula C10H11ClO and a molecular weight of 182.65 g/mol. Its IUPAC name is 3-chloro-2-(2-methylcyclopropyl)phenol.

Molecular Properties

Compound Name3-chloro-2-(2-methylcyclopropyl)phenol
PubChem CID89070778
Molecular FormulaC10H11ClO
Molecular Weight182.65 g/mol
Exact Mass182.05
IUPAC Name3-chloro-2-(2-methylcyclopropyl)phenol
SMILESCC1CC1c1c(O)cccc1Cl
InChIInChI=1S/C10H11ClO/c1-6-5-7(6)10-8(11)3-2-4-9(10)12/h2-4,6-7,12H,5H2,1H3
InChIKeyFRWAVCMHGRQBJM-UHFFFAOYSA-N
XLogP3.17
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 ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-chloro-2-(2-methylcyclopropyl)phenol?
The IUPAC name of 3-chloro-2-(2-methylcyclopropyl)phenol (CID 89070778) is 3-chloro-2-(2-methylcyclopropyl)phenol.
What is the SMILES notation for 3-chloro-2-(2-methylcyclopropyl)phenol?
The canonical SMILES for 3-chloro-2-(2-methylcyclopropyl)phenol is CC1CC1c1c(O)cccc1Cl.
What is the InChIKey of 3-chloro-2-(2-methylcyclopropyl)phenol?
The InChIKey is FRWAVCMHGRQBJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11ClO/c1-6-5-7(6)10-8(11)3-2-4-9(10)12/h2-4,6-7,12H,5H2,1H3.
What are the key properties of 3-chloro-2-(2-methylcyclopropyl)phenol?
3-chloro-2-(2-methylcyclopropyl)phenol has a molecular weight of 182.65 g/mol, XLogP of 3.17, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-2-(2-methylcyclopropyl)phenol is sourced from PubChem (CID 89070778), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).