CID 15657314

C₄H₇O — CID 15657314

About CID 15657314

CID 15657314 (PubChem CID 15657314) has the molecular formula C₄H₇O and a molecular weight of 71.10 g/mol.

Molecular Properties

• Compound Name: CID 15657314
• PubChem CID: 15657314
• Molecular Formula: C₄H₇O
• Molecular Weight: 71.10 g/mol
• Exact Mass: 71.05
• IUPAC Name: —
• SMILES: [CH2]COC=C
• InChI: InChI=1S/C4H7O/c1-3-5-4-2/h3H,1-2,4H2
• InChIKey: HYAIRCIQEQWVDE-UHFFFAOYSA-N
• XLogP: 0.98
• TPSA: 9.23 Ų
• H-Bond Acceptors: 1
• Rotatable Bonds: 2
• Heavy Atoms: 5
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	71.10
LogP ≤ 5	0.98
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	1

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of CID 15657314?

The IUPAC name of CID 15657314 (CID 15657314) is not available.

What is the SMILES notation for CID 15657314?

The canonical SMILES for CID 15657314 is [CH2]COC=C.

What is the InChIKey of CID 15657314?

The InChIKey is HYAIRCIQEQWVDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7O/c1-3-5-4-2/h3H,1-2,4H2.

What are the key properties of CID 15657314?

CID 15657314 has a molecular weight of 71.10 g/mol, XLogP of 0.98, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.

Where does this data come from?

All data for CID 15657314 is sourced from PubChem (CID 15657314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 15657314 — identifiers, structure, computed properties (public domain)

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