cyclopent-3-en-1-ol;hydrochloride

C5H9ClO — CID 175482994

IUPACcyclopent-3-en-1-ol;hydrochloride
SMILESCl.OC1CC=CC1
InChIInChI=1S/C5H8O.ClH/c6-5-3-1-2-4-5;/h1-2,5-6H,3-4H2;1H
InChIKeyCZFHJIXXAQNQTI-UHFFFAOYSA-N
MW120.58 g/mol
LogP1.12
Rot. Bonds

About cyclopent-3-en-1-ol;hydrochloride

cyclopent-3-en-1-ol;hydrochloride (PubChem CID 175482994) has the molecular formula C5H9ClO and a molecular weight of 120.58 g/mol. Its IUPAC name is cyclopent-3-en-1-ol;hydrochloride.

Molecular Properties

Compound Namecyclopent-3-en-1-ol;hydrochloride
PubChem CID175482994
Molecular FormulaC5H9ClO
Molecular Weight120.58 g/mol
Exact Mass120.03
IUPAC Namecyclopent-3-en-1-ol;hydrochloride
SMILESCl.OC1CC=CC1
InChIInChI=1S/C5H8O.ClH/c6-5-3-1-2-4-5;/h1-2,5-6H,3-4H2;1H
InChIKeyCZFHJIXXAQNQTI-UHFFFAOYSA-N
XLogP1.12
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500120.58
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of cyclopent-3-en-1-ol;hydrochloride?
The IUPAC name of cyclopent-3-en-1-ol;hydrochloride (CID 175482994) is cyclopent-3-en-1-ol;hydrochloride.
What is the SMILES notation for cyclopent-3-en-1-ol;hydrochloride?
The canonical SMILES for cyclopent-3-en-1-ol;hydrochloride is Cl.OC1CC=CC1.
What is the InChIKey of cyclopent-3-en-1-ol;hydrochloride?
The InChIKey is CZFHJIXXAQNQTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8O.ClH/c6-5-3-1-2-4-5;/h1-2,5-6H,3-4H2;1H.
What are the key properties of cyclopent-3-en-1-ol;hydrochloride?
cyclopent-3-en-1-ol;hydrochloride has a molecular weight of 120.58 g/mol, XLogP of 1.12, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopent-3-en-1-ol;hydrochloride is sourced from PubChem (CID 175482994), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).