ethyl-dimethyl-(5-methylhexyl)phosphanium

C11H26P+ — CID 90936970

IUPACethyl-dimethyl-(5-methylhexyl)phosphanium
SMILESCC[P+](C)(C)CCCCC(C)C
InChIInChI=1S/C11H26P/c1-6-12(4,5)10-8-7-9-11(2)3/h11H,6-10H2,1-5H3/q+1
InChIKeyIXLWORGHHQWNEB-UHFFFAOYSA-N
MW189.30 g/mol
LogP4.11
Rot. Bonds6

About ethyl-dimethyl-(5-methylhexyl)phosphanium

ethyl-dimethyl-(5-methylhexyl)phosphanium (PubChem CID 90936970) has the molecular formula C11H26P+ and a molecular weight of 189.30 g/mol. Its IUPAC name is ethyl-dimethyl-(5-methylhexyl)phosphanium.

Molecular Properties

Compound Nameethyl-dimethyl-(5-methylhexyl)phosphanium
PubChem CID90936970
Molecular FormulaC11H26P+
Molecular Weight189.30 g/mol
Exact Mass189.18
IUPAC Nameethyl-dimethyl-(5-methylhexyl)phosphanium
SMILESCC[P+](C)(C)CCCCC(C)C
InChIInChI=1S/C11H26P/c1-6-12(4,5)10-8-7-9-11(2)3/h11H,6-10H2,1-5H3/q+1
InChIKeyIXLWORGHHQWNEB-UHFFFAOYSA-N
XLogP4.11
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.30
LogP ≤ 54.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

2,9-dimethyldecane;2,11-dimethyldodecane;2,8-dimethylnonane;2,7-dimethyloctane;2,10-dimethylundecane
CID 161261647
2,22-dimethyltricosane
CID 58100191
2-methylbutane;2-methyltridecane
CID 54106775
2-methyltetratriacontane
CID 14275207
2-methylpentaoctacontane
CID 90745672
2-methyldecane
CID 23415
2-methyloctacosane
CID 519147
2,11,23-trimethylpentacosane
CID 123728262
methane;2-methylicosane
CID 157337652
2-methylnonane;heptahydrofluoride
CID 160801749
alumane;2-methyldecane
CID 174844655
azane;2-methyloctadecane
CID 175414560

Frequently Asked Questions

What is the IUPAC name of ethyl-dimethyl-(5-methylhexyl)phosphanium?
The IUPAC name of ethyl-dimethyl-(5-methylhexyl)phosphanium (CID 90936970) is ethyl-dimethyl-(5-methylhexyl)phosphanium.
What is the SMILES notation for ethyl-dimethyl-(5-methylhexyl)phosphanium?
The canonical SMILES for ethyl-dimethyl-(5-methylhexyl)phosphanium is CC[P+](C)(C)CCCCC(C)C.
What is the InChIKey of ethyl-dimethyl-(5-methylhexyl)phosphanium?
The InChIKey is IXLWORGHHQWNEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26P/c1-6-12(4,5)10-8-7-9-11(2)3/h11H,6-10H2,1-5H3/q+1.
What are the key properties of ethyl-dimethyl-(5-methylhexyl)phosphanium?
ethyl-dimethyl-(5-methylhexyl)phosphanium has a molecular weight of 189.30 g/mol, XLogP of 4.11, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl-dimethyl-(5-methylhexyl)phosphanium is sourced from PubChem (CID 90936970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).