2-ethylbutoxy(phenyl)phosphane

C12H19OP — CID 150663932

IUPAC2-ethylbutoxy(phenyl)phosphane
SMILESCCC(CC)COPc1ccccc1
InChIInChI=1S/C12H19OP/c1-3-11(4-2)10-13-14-12-8-6-5-7-9-12/h5-9,11,14H,3-4,10H2,1-2H3
InChIKeyJELOGHKOWZUSJQ-UHFFFAOYSA-N
MW210.26 g/mol
LogP3.36
Rot. Bonds6

About 2-ethylbutoxy(phenyl)phosphane

2-ethylbutoxy(phenyl)phosphane (PubChem CID 150663932) has the molecular formula C12H19OP and a molecular weight of 210.26 g/mol. Its IUPAC name is 2-ethylbutoxy(phenyl)phosphane.

Molecular Properties

Compound Name2-ethylbutoxy(phenyl)phosphane
PubChem CID150663932
Molecular FormulaC12H19OP
Molecular Weight210.26 g/mol
Exact Mass210.12
IUPAC Name2-ethylbutoxy(phenyl)phosphane
SMILESCCC(CC)COPc1ccccc1
InChIInChI=1S/C12H19OP/c1-3-11(4-2)10-13-14-12-8-6-5-7-9-12/h5-9,11,14H,3-4,10H2,1-2H3
InChIKeyJELOGHKOWZUSJQ-UHFFFAOYSA-N
XLogP3.36
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.26
LogP ≤ 53.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-ethylhexoxy(phenoxy)phosphane
CID 23385803
1,3-bis(2-ethylbutoxy)benzene
CID 118415236
bis(diphenylphosphane);ethanol
CID 175242741
diphenylphosphane;ethylphosphane
CID 158116406
2-(2-ethylbutoxy)-N-methyl-1-phenylethanamine
CID 114208303
diphenyl(1-phenylphosphanylpropyl)phosphane
CID 173220506
bis(2-ethylbutyl) 2,5-diphenylhexanedioate
CID 518262
2-ethylbutylbenzene;methane
CID 158777195
diphenylphosphane;octane
CID 19797985
ethane;ethyl(phenyl)phosphane;neodymium
CID 87739299
2-ethylbutyl (2R)-2-amino-3-phenylpropanoate
CID 114208438
2-ethylbutyl 2-amino-3-phenylpropanoate;phenol
CID 168915046

Frequently Asked Questions

What is the IUPAC name of 2-ethylbutoxy(phenyl)phosphane?
The IUPAC name of 2-ethylbutoxy(phenyl)phosphane (CID 150663932) is 2-ethylbutoxy(phenyl)phosphane.
What is the SMILES notation for 2-ethylbutoxy(phenyl)phosphane?
The canonical SMILES for 2-ethylbutoxy(phenyl)phosphane is CCC(CC)COPc1ccccc1.
What is the InChIKey of 2-ethylbutoxy(phenyl)phosphane?
The InChIKey is JELOGHKOWZUSJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19OP/c1-3-11(4-2)10-13-14-12-8-6-5-7-9-12/h5-9,11,14H,3-4,10H2,1-2H3.
What are the key properties of 2-ethylbutoxy(phenyl)phosphane?
2-ethylbutoxy(phenyl)phosphane has a molecular weight of 210.26 g/mol, XLogP of 3.36, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethylbutoxy(phenyl)phosphane is sourced from PubChem (CID 150663932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).