2-cyclopropylethyl hypochlorite

C5H9ClO — CID 172781000

IUPAC2-cyclopropylethyl hypochlorite
SMILESClOCCC1CC1
InChIInChI=1S/C5H9ClO/c6-7-4-3-5-1-2-5/h5H,1-4H2
InChIKeyOGEMCXSPLWEKFH-UHFFFAOYSA-N
MW120.58 g/mol
LogP1.96
Rot. Bonds3

About 2-cyclopropylethyl hypochlorite

2-cyclopropylethyl hypochlorite (PubChem CID 172781000) has the molecular formula C5H9ClO and a molecular weight of 120.58 g/mol. Its IUPAC name is 2-cyclopropylethyl hypochlorite.

Molecular Properties

Compound Name2-cyclopropylethyl hypochlorite
PubChem CID172781000
Molecular FormulaC5H9ClO
Molecular Weight120.58 g/mol
Exact Mass120.03
IUPAC Name2-cyclopropylethyl hypochlorite
SMILESClOCCC1CC1
InChIInChI=1S/C5H9ClO/c6-7-4-3-5-1-2-5/h5H,1-4H2
InChIKeyOGEMCXSPLWEKFH-UHFFFAOYSA-N
XLogP1.96
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500120.58
LogP ≤ 51.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopropylethyl hypochlorite?
The IUPAC name of 2-cyclopropylethyl hypochlorite (CID 172781000) is 2-cyclopropylethyl hypochlorite.
What is the SMILES notation for 2-cyclopropylethyl hypochlorite?
The canonical SMILES for 2-cyclopropylethyl hypochlorite is ClOCCC1CC1.
What is the InChIKey of 2-cyclopropylethyl hypochlorite?
The InChIKey is OGEMCXSPLWEKFH-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9ClO/c6-7-4-3-5-1-2-5/h5H,1-4H2.
What are the key properties of 2-cyclopropylethyl hypochlorite?
2-cyclopropylethyl hypochlorite has a molecular weight of 120.58 g/mol, XLogP of 1.96, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopropylethyl hypochlorite is sourced from PubChem (CID 172781000), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).