1-(3-chloro-4-methylphenyl)cyclopropan-1-ol

C10H11ClO — CID 63195490

IUPAC1-(3-chloro-4-methylphenyl)cyclopropan-1-ol
SMILESCc1ccc(C2(O)CC2)cc1Cl
InChIInChI=1S/C10H11ClO/c1-7-2-3-8(6-9(7)11)10(12)4-5-10/h2-3,6,12H,4-5H2,1H3
InChIKeyKXQYDGUKHVIHOK-UHFFFAOYSA-N
MW182.65 g/mol
LogP2.63
Rot. Bonds1

About 1-(3-chloro-4-methylphenyl)cyclopropan-1-ol

1-(3-chloro-4-methylphenyl)cyclopropan-1-ol (PubChem CID 63195490) has the molecular formula C10H11ClO and a molecular weight of 182.65 g/mol. Its IUPAC name is 1-(3-chloro-4-methylphenyl)cyclopropan-1-ol.

Molecular Properties

Compound Name1-(3-chloro-4-methylphenyl)cyclopropan-1-ol
PubChem CID63195490
Molecular FormulaC10H11ClO
Molecular Weight182.65 g/mol
Exact Mass182.05
IUPAC Name1-(3-chloro-4-methylphenyl)cyclopropan-1-ol
SMILESCc1ccc(C2(O)CC2)cc1Cl
InChIInChI=1S/C10H11ClO/c1-7-2-3-8(6-9(7)11)10(12)4-5-10/h2-3,6,12H,4-5H2,1H3
InChIKeyKXQYDGUKHVIHOK-UHFFFAOYSA-N
XLogP2.63
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 ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(3-chloro-4-methylphenyl)cyclopropan-1-ol?
The IUPAC name of 1-(3-chloro-4-methylphenyl)cyclopropan-1-ol (CID 63195490) is 1-(3-chloro-4-methylphenyl)cyclopropan-1-ol.
What is the SMILES notation for 1-(3-chloro-4-methylphenyl)cyclopropan-1-ol?
The canonical SMILES for 1-(3-chloro-4-methylphenyl)cyclopropan-1-ol is Cc1ccc(C2(O)CC2)cc1Cl.
What is the InChIKey of 1-(3-chloro-4-methylphenyl)cyclopropan-1-ol?
The InChIKey is KXQYDGUKHVIHOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11ClO/c1-7-2-3-8(6-9(7)11)10(12)4-5-10/h2-3,6,12H,4-5H2,1H3.
What are the key properties of 1-(3-chloro-4-methylphenyl)cyclopropan-1-ol?
1-(3-chloro-4-methylphenyl)cyclopropan-1-ol has a molecular weight of 182.65 g/mol, XLogP of 2.63, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-chloro-4-methylphenyl)cyclopropan-1-ol is sourced from PubChem (CID 63195490), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).