dimethyl-methylidene-prop-1-en-2-yl-λ5-phosphane

C6H13P — CID 21365902

IUPACdimethyl-methylidene-prop-1-en-2-yl-λ5-phosphane
SMILESC=C(C)P(=C)(C)C
InChIInChI=1S/C6H13P/c1-6(2)7(3,4)5/h1,3H2,2,4-5H3
InChIKeyLGSIGYDUFFWCJH-UHFFFAOYSA-N
MW116.14 g/mol
LogP2.23
Rot. Bonds1

About dimethyl-methylidene-prop-1-en-2-yl-λ5-phosphane

dimethyl-methylidene-prop-1-en-2-yl-λ5-phosphane (PubChem CID 21365902) has the molecular formula C6H13P and a molecular weight of 116.14 g/mol. Its IUPAC name is dimethyl-methylidene-prop-1-en-2-yl-λ5-phosphane.

Molecular Properties

Compound Namedimethyl-methylidene-prop-1-en-2-yl-λ5-phosphane
PubChem CID21365902
Molecular FormulaC6H13P
Molecular Weight116.14 g/mol
Exact Mass116.08
IUPAC Namedimethyl-methylidene-prop-1-en-2-yl-λ5-phosphane
SMILESC=C(C)P(=C)(C)C
InChIInChI=1S/C6H13P/c1-6(2)7(3,4)5/h1,3H2,2,4-5H3
InChIKeyLGSIGYDUFFWCJH-UHFFFAOYSA-N
XLogP2.23
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500116.14
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of dimethyl-methylidene-prop-1-en-2-yl-λ5-phosphane?
The IUPAC name of dimethyl-methylidene-prop-1-en-2-yl-λ5-phosphane (CID 21365902) is dimethyl-methylidene-prop-1-en-2-yl-λ5-phosphane.
What is the SMILES notation for dimethyl-methylidene-prop-1-en-2-yl-λ5-phosphane?
The canonical SMILES for dimethyl-methylidene-prop-1-en-2-yl-λ5-phosphane is C=C(C)P(=C)(C)C.
What is the InChIKey of dimethyl-methylidene-prop-1-en-2-yl-λ5-phosphane?
The InChIKey is LGSIGYDUFFWCJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H13P/c1-6(2)7(3,4)5/h1,3H2,2,4-5H3.
What are the key properties of dimethyl-methylidene-prop-1-en-2-yl-λ5-phosphane?
dimethyl-methylidene-prop-1-en-2-yl-λ5-phosphane has a molecular weight of 116.14 g/mol, XLogP of 2.23, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-methylidene-prop-1-en-2-yl-λ5-phosphane is sourced from PubChem (CID 21365902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).