methyl-bis(prop-2-enyl)phosphane

C7H13P — CID 13438955

IUPACmethyl-bis(prop-2-enyl)phosphane
SMILESC=CCP(C)CC=C
InChIInChI=1S/C7H13P/c1-4-6-8(3)7-5-2/h4-5H,1-2,6-7H2,3H3
InChIKeyWYTWNROSKWTREC-UHFFFAOYSA-N
MW128.15 g/mol
LogP2.47
Rot. Bonds4

About methyl-bis(prop-2-enyl)phosphane

methyl-bis(prop-2-enyl)phosphane (PubChem CID 13438955) has the molecular formula C7H13P and a molecular weight of 128.15 g/mol. Its IUPAC name is methyl-bis(prop-2-enyl)phosphane.

Molecular Properties

Compound Namemethyl-bis(prop-2-enyl)phosphane
PubChem CID13438955
Molecular FormulaC7H13P
Molecular Weight128.15 g/mol
Exact Mass128.08
IUPAC Namemethyl-bis(prop-2-enyl)phosphane
SMILESC=CCP(C)CC=C
InChIInChI=1S/C7H13P/c1-4-6-8(3)7-5-2/h4-5H,1-2,6-7H2,3H3
InChIKeyWYTWNROSKWTREC-UHFFFAOYSA-N
XLogP2.47
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500128.15
LogP ≤ 52.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of methyl-bis(prop-2-enyl)phosphane?
The IUPAC name of methyl-bis(prop-2-enyl)phosphane (CID 13438955) is methyl-bis(prop-2-enyl)phosphane.
What is the SMILES notation for methyl-bis(prop-2-enyl)phosphane?
The canonical SMILES for methyl-bis(prop-2-enyl)phosphane is C=CCP(C)CC=C.
What is the InChIKey of methyl-bis(prop-2-enyl)phosphane?
The InChIKey is WYTWNROSKWTREC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13P/c1-4-6-8(3)7-5-2/h4-5H,1-2,6-7H2,3H3.
What are the key properties of methyl-bis(prop-2-enyl)phosphane?
methyl-bis(prop-2-enyl)phosphane has a molecular weight of 128.15 g/mol, XLogP of 2.47, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for methyl-bis(prop-2-enyl)phosphane is sourced from PubChem (CID 13438955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).