(5,7-dimethyl-6-methylidenedeca-2,4,7,9-tetraen-4-yl)phosphane

C13H19P — CID 90799740

IUPAC(5,7-dimethyl-6-methylidenedeca-2,4,7,9-tetraen-4-yl)phosphane
SMILESC=CC=C(C)C(=C)C(C)=C(P)C=CC
InChIInChI=1S/C13H19P/c1-6-8-10(3)11(4)12(5)13(14)9-7-2/h6-9H,1,4,14H2,2-3,5H3
InChIKeyQNDRKTBHHSQLBI-UHFFFAOYSA-N
MW206.27 g/mol
LogP4.40
Rot. Bonds4

About (5,7-dimethyl-6-methylidenedeca-2,4,7,9-tetraen-4-yl)phosphane

(5,7-dimethyl-6-methylidenedeca-2,4,7,9-tetraen-4-yl)phosphane (PubChem CID 90799740) has the molecular formula C13H19P and a molecular weight of 206.27 g/mol. Its IUPAC name is (5,7-dimethyl-6-methylidenedeca-2,4,7,9-tetraen-4-yl)phosphane.

Molecular Properties

Compound Name(5,7-dimethyl-6-methylidenedeca-2,4,7,9-tetraen-4-yl)phosphane
PubChem CID90799740
Molecular FormulaC13H19P
Molecular Weight206.27 g/mol
Exact Mass206.12
IUPAC Name(5,7-dimethyl-6-methylidenedeca-2,4,7,9-tetraen-4-yl)phosphane
SMILESC=CC=C(C)C(=C)C(C)=C(P)C=CC
InChIInChI=1S/C13H19P/c1-6-8-10(3)11(4)12(5)13(14)9-7-2/h6-9H,1,4,14H2,2-3,5H3
InChIKeyQNDRKTBHHSQLBI-UHFFFAOYSA-N
XLogP4.40
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.27
LogP ≤ 54.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (5,7-dimethyl-6-methylidenedeca-2,4,7,9-tetraen-4-yl)phosphane?
The IUPAC name of (5,7-dimethyl-6-methylidenedeca-2,4,7,9-tetraen-4-yl)phosphane (CID 90799740) is (5,7-dimethyl-6-methylidenedeca-2,4,7,9-tetraen-4-yl)phosphane.
What is the SMILES notation for (5,7-dimethyl-6-methylidenedeca-2,4,7,9-tetraen-4-yl)phosphane?
The canonical SMILES for (5,7-dimethyl-6-methylidenedeca-2,4,7,9-tetraen-4-yl)phosphane is C=CC=C(C)C(=C)C(C)=C(P)C=CC.
What is the InChIKey of (5,7-dimethyl-6-methylidenedeca-2,4,7,9-tetraen-4-yl)phosphane?
The InChIKey is QNDRKTBHHSQLBI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19P/c1-6-8-10(3)11(4)12(5)13(14)9-7-2/h6-9H,1,4,14H2,2-3,5H3.
What are the key properties of (5,7-dimethyl-6-methylidenedeca-2,4,7,9-tetraen-4-yl)phosphane?
(5,7-dimethyl-6-methylidenedeca-2,4,7,9-tetraen-4-yl)phosphane has a molecular weight of 206.27 g/mol, XLogP of 4.40, 4 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (5,7-dimethyl-6-methylidenedeca-2,4,7,9-tetraen-4-yl)phosphane is sourced from PubChem (CID 90799740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).