2-chlorocyclopropan-1-ol

C3H5ClO — CID 13351704

IUPAC2-chlorocyclopropan-1-ol
SMILESOC1CC1Cl
InChIInChI=1S/C3H5ClO/c4-2-1-3(2)5/h2-3,5H,1H2
InChIKeyFPRZZQZXVVNHMP-UHFFFAOYSA-N
MW92.52 g/mol
LogP0.36
Rot. Bonds

About 2-chlorocyclopropan-1-ol

2-chlorocyclopropan-1-ol (PubChem CID 13351704) has the molecular formula C3H5ClO and a molecular weight of 92.52 g/mol. Its IUPAC name is 2-chlorocyclopropan-1-ol.

Molecular Properties

Compound Name2-chlorocyclopropan-1-ol
PubChem CID13351704
Molecular FormulaC3H5ClO
Molecular Weight92.52 g/mol
Exact Mass92.00
IUPAC Name2-chlorocyclopropan-1-ol
SMILESOC1CC1Cl
InChIInChI=1S/C3H5ClO/c4-2-1-3(2)5/h2-3,5H,1H2
InChIKeyFPRZZQZXVVNHMP-UHFFFAOYSA-N
XLogP0.36
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50092.52
LogP ≤ 50.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-chlorocyclopropan-1-ol?
The IUPAC name of 2-chlorocyclopropan-1-ol (CID 13351704) is 2-chlorocyclopropan-1-ol.
What is the SMILES notation for 2-chlorocyclopropan-1-ol?
The canonical SMILES for 2-chlorocyclopropan-1-ol is OC1CC1Cl.
What is the InChIKey of 2-chlorocyclopropan-1-ol?
The InChIKey is FPRZZQZXVVNHMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H5ClO/c4-2-1-3(2)5/h2-3,5H,1H2.
What are the key properties of 2-chlorocyclopropan-1-ol?
2-chlorocyclopropan-1-ol has a molecular weight of 92.52 g/mol, XLogP of 0.36, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chlorocyclopropan-1-ol is sourced from PubChem (CID 13351704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).