1-(2-chlorophenyl)-2-propylcyclopropan-1-ol

C12H15ClO — CID 79332474

IUPAC1-(2-chlorophenyl)-2-propylcyclopropan-1-ol
SMILESCCCC1CC1(O)c1ccccc1Cl
InChIInChI=1S/C12H15ClO/c1-2-5-9-8-12(9,14)10-6-3-4-7-11(10)13/h3-4,6-7,9,14H,2,5,8H2,1H3
InChIKeyQOJQNUOYBLPCBS-UHFFFAOYSA-N
MW210.70 g/mol
LogP3.35
Rot. Bonds3

About 1-(2-chlorophenyl)-2-propylcyclopropan-1-ol

1-(2-chlorophenyl)-2-propylcyclopropan-1-ol (PubChem CID 79332474) has the molecular formula C12H15ClO and a molecular weight of 210.70 g/mol. Its IUPAC name is 1-(2-chlorophenyl)-2-propylcyclopropan-1-ol.

Molecular Properties

Compound Name1-(2-chlorophenyl)-2-propylcyclopropan-1-ol
PubChem CID79332474
Molecular FormulaC12H15ClO
Molecular Weight210.70 g/mol
Exact Mass210.08
IUPAC Name1-(2-chlorophenyl)-2-propylcyclopropan-1-ol
SMILESCCCC1CC1(O)c1ccccc1Cl
InChIInChI=1S/C12H15ClO/c1-2-5-9-8-12(9,14)10-6-3-4-7-11(10)13/h3-4,6-7,9,14H,2,5,8H2,1H3
InChIKeyQOJQNUOYBLPCBS-UHFFFAOYSA-N
XLogP3.35
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.70
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(2-chlorophenyl)-2-propylcyclopropan-1-ol?
The IUPAC name of 1-(2-chlorophenyl)-2-propylcyclopropan-1-ol (CID 79332474) is 1-(2-chlorophenyl)-2-propylcyclopropan-1-ol.
What is the SMILES notation for 1-(2-chlorophenyl)-2-propylcyclopropan-1-ol?
The canonical SMILES for 1-(2-chlorophenyl)-2-propylcyclopropan-1-ol is CCCC1CC1(O)c1ccccc1Cl.
What is the InChIKey of 1-(2-chlorophenyl)-2-propylcyclopropan-1-ol?
The InChIKey is QOJQNUOYBLPCBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15ClO/c1-2-5-9-8-12(9,14)10-6-3-4-7-11(10)13/h3-4,6-7,9,14H,2,5,8H2,1H3.
What are the key properties of 1-(2-chlorophenyl)-2-propylcyclopropan-1-ol?
1-(2-chlorophenyl)-2-propylcyclopropan-1-ol has a molecular weight of 210.70 g/mol, XLogP of 3.35, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-chlorophenyl)-2-propylcyclopropan-1-ol is sourced from PubChem (CID 79332474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).