dodec-2-enylphosphane

C12H25P — CID 123161418

IUPACdodec-2-enylphosphane
SMILESCCCCCCCCCC=CCP
InChIInChI=1S/C12H25P/c1-2-3-4-5-6-7-8-9-10-11-12-13/h10-11H,2-9,12-13H2,1H3
InChIKeyDHXHGRXYQXGTRP-UHFFFAOYSA-N
MW200.31 g/mol
LogP4.56
Rot. Bonds9

About dodec-2-enylphosphane

dodec-2-enylphosphane (PubChem CID 123161418) has the molecular formula C12H25P and a molecular weight of 200.31 g/mol. Its IUPAC name is dodec-2-enylphosphane.

Molecular Properties

Compound Namedodec-2-enylphosphane
PubChem CID123161418
Molecular FormulaC12H25P
Molecular Weight200.31 g/mol
Exact Mass200.17
IUPAC Namedodec-2-enylphosphane
SMILESCCCCCCCCCC=CCP
InChIInChI=1S/C12H25P/c1-2-3-4-5-6-7-8-9-10-11-12-13/h10-11H,2-9,12-13H2,1H3
InChIKeyDHXHGRXYQXGTRP-UHFFFAOYSA-N
XLogP4.56
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds9
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.31
LogP ≤ 54.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

(E)-hexadec-6-ene
CID 5352260
(Z)-docos-9-ene
CID 11690102
(E)-hexacos-10-ene
CID 22172169
(E)-nonacos-10-ene
CID 14367300
tetratriacont-8-ene
CID 123670593
(E)-icos-10-ene
CID 10468895
heptatriacont-13-ene
CID 71378710
(E)-docos-6-ene
CID 22172020
triacont-12-ene
CID 54535715
(Z)-octadec-6-ene
CID 5352239
(24Z)-hexatriaconta-9,24-diene
CID 173127472
(Z)-heptacos-11-ene
CID 56936074

Frequently Asked Questions

What is the IUPAC name of dodec-2-enylphosphane?
The IUPAC name of dodec-2-enylphosphane (CID 123161418) is dodec-2-enylphosphane.
What is the SMILES notation for dodec-2-enylphosphane?
The canonical SMILES for dodec-2-enylphosphane is CCCCCCCCCC=CCP.
What is the InChIKey of dodec-2-enylphosphane?
The InChIKey is DHXHGRXYQXGTRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25P/c1-2-3-4-5-6-7-8-9-10-11-12-13/h10-11H,2-9,12-13H2,1H3.
What are the key properties of dodec-2-enylphosphane?
dodec-2-enylphosphane has a molecular weight of 200.31 g/mol, XLogP of 4.56, 9 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dodec-2-enylphosphane is sourced from PubChem (CID 123161418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).