(Z)-2-dimethylphosphanylethenol

C4H9OP — CID 58517827

IUPAC(Z)-2-dimethylphosphanylethenol
SMILESCP(C)/C=C\O
InChIInChI=1S/C4H9OP/c1-6(2)4-3-5/h3-5H,1-2H3/b4-3-
InChIKeyZRKFYLSMLSNXAP-ARJAWSKDSA-N
MW104.09 g/mol
LogP1.76
Rot. Bonds1

About (Z)-2-dimethylphosphanylethenol

(Z)-2-dimethylphosphanylethenol (PubChem CID 58517827) has the molecular formula C4H9OP and a molecular weight of 104.09 g/mol. Its IUPAC name is (Z)-2-dimethylphosphanylethenol.

Molecular Properties

Compound Name(Z)-2-dimethylphosphanylethenol
PubChem CID58517827
Molecular FormulaC4H9OP
Molecular Weight104.09 g/mol
Exact Mass104.04
IUPAC Name(Z)-2-dimethylphosphanylethenol
SMILESCP(C)/C=C\O
InChIInChI=1S/C4H9OP/c1-6(2)4-3-5/h3-5H,1-2H3/b4-3-
InChIKeyZRKFYLSMLSNXAP-ARJAWSKDSA-N
XLogP1.76
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500104.09
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (Z)-2-dimethylphosphanylethenol?
The IUPAC name of (Z)-2-dimethylphosphanylethenol (CID 58517827) is (Z)-2-dimethylphosphanylethenol.
What is the SMILES notation for (Z)-2-dimethylphosphanylethenol?
The canonical SMILES for (Z)-2-dimethylphosphanylethenol is CP(C)/C=C\O.
What is the InChIKey of (Z)-2-dimethylphosphanylethenol?
The InChIKey is ZRKFYLSMLSNXAP-ARJAWSKDSA-N. The full InChI is InChI=1S/C4H9OP/c1-6(2)4-3-5/h3-5H,1-2H3/b4-3-.
What are the key properties of (Z)-2-dimethylphosphanylethenol?
(Z)-2-dimethylphosphanylethenol has a molecular weight of 104.09 g/mol, XLogP of 1.76, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-2-dimethylphosphanylethenol is sourced from PubChem (CID 58517827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).