[(2S,5S)-5-(2-chloroethenyl)oxolan-2-yl]methanol

C7H11ClO2 — CID 59064031

IUPAC[(2S,5S)-5-(2-chloroethenyl)oxolan-2-yl]methanol
SMILESOC[C@@H]1CC[C@@H](C=CCl)O1
InChIInChI=1S/C7H11ClO2/c8-4-3-6-1-2-7(5-9)10-6/h3-4,6-7,9H,1-2,5H2/t6-,7-/m0/s1
InChIKeyGZCOODFOWLDPDL-BQBZGAKWSA-N
MW162.62 g/mol
LogP1.28
Rot. Bonds2

About [(2S,5S)-5-(2-chloroethenyl)oxolan-2-yl]methanol

[(2S,5S)-5-(2-chloroethenyl)oxolan-2-yl]methanol (PubChem CID 59064031) has the molecular formula C7H11ClO2 and a molecular weight of 162.62 g/mol. Its IUPAC name is [(2S,5S)-5-(2-chloroethenyl)oxolan-2-yl]methanol.

Molecular Properties

Compound Name[(2S,5S)-5-(2-chloroethenyl)oxolan-2-yl]methanol
PubChem CID59064031
Molecular FormulaC7H11ClO2
Molecular Weight162.62 g/mol
Exact Mass162.04
IUPAC Name[(2S,5S)-5-(2-chloroethenyl)oxolan-2-yl]methanol
SMILESOC[C@@H]1CC[C@@H](C=CCl)O1
InChIInChI=1S/C7H11ClO2/c8-4-3-6-1-2-7(5-9)10-6/h3-4,6-7,9H,1-2,5H2/t6-,7-/m0/s1
InChIKeyGZCOODFOWLDPDL-BQBZGAKWSA-N
XLogP1.28
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.62
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze [(2S,5S)-5-(2-chloroethenyl)oxolan-2-yl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [(2S,5S)-5-(2-chloroethenyl)oxolan-2-yl]methanol?
The IUPAC name of [(2S,5S)-5-(2-chloroethenyl)oxolan-2-yl]methanol (CID 59064031) is [(2S,5S)-5-(2-chloroethenyl)oxolan-2-yl]methanol.
What is the SMILES notation for [(2S,5S)-5-(2-chloroethenyl)oxolan-2-yl]methanol?
The canonical SMILES for [(2S,5S)-5-(2-chloroethenyl)oxolan-2-yl]methanol is OC[C@@H]1CC[C@@H](C=CCl)O1.
What is the InChIKey of [(2S,5S)-5-(2-chloroethenyl)oxolan-2-yl]methanol?
The InChIKey is GZCOODFOWLDPDL-BQBZGAKWSA-N. The full InChI is InChI=1S/C7H11ClO2/c8-4-3-6-1-2-7(5-9)10-6/h3-4,6-7,9H,1-2,5H2/t6-,7-/m0/s1.
What are the key properties of [(2S,5S)-5-(2-chloroethenyl)oxolan-2-yl]methanol?
[(2S,5S)-5-(2-chloroethenyl)oxolan-2-yl]methanol has a molecular weight of 162.62 g/mol, XLogP of 1.28, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S,5S)-5-(2-chloroethenyl)oxolan-2-yl]methanol is sourced from PubChem (CID 59064031), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).