tert-butyl-di(propan-2-yl)phosphane

C10H23P — CID 555002

IUPACtert-butyl-di(propan-2-yl)phosphane
SMILESCC(C)P(C(C)C)C(C)(C)C
InChIInChI=1S/C10H23P/c1-8(2)11(9(3)4)10(5,6)7/h8-9H,1-7H3
InChIKeyOLSMQSZDUXXYAY-UHFFFAOYSA-N
MW174.27 g/mol
LogP4.08
Rot. Bonds2

About tert-butyl-di(propan-2-yl)phosphane

tert-butyl-di(propan-2-yl)phosphane (PubChem CID 555002) has the molecular formula C10H23P and a molecular weight of 174.27 g/mol. Its IUPAC name is tert-butyl-di(propan-2-yl)phosphane.

Molecular Properties

Compound Nametert-butyl-di(propan-2-yl)phosphane
PubChem CID555002
Molecular FormulaC10H23P
Molecular Weight174.27 g/mol
Exact Mass174.15
IUPAC Nametert-butyl-di(propan-2-yl)phosphane
SMILESCC(C)P(C(C)C)C(C)(C)C
InChIInChI=1S/C10H23P/c1-8(2)11(9(3)4)10(5,6)7/h8-9H,1-7H3
InChIKeyOLSMQSZDUXXYAY-UHFFFAOYSA-N
XLogP4.08
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.27
LogP ≤ 54.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

Tributylphosphine
CID 13831
Dibutylchlorophosphine
CID 305896
Phosphonium, tributylmethyl-, iodide (1:1)
CID 2760114
Tributylphosphine sulfide
CID 76515
Triisopropylphosphine
CID 80969
Phosphine sulfide, tris(2-methylpropyl)-
CID 99410
Tris(1,1-dimethylethyl)phosphine
CID 83681
Phosphine, bis(1,1-dimethylethyl)-
CID 136643
Di-tert-butylchlorophosphine
CID 139566
Phosphine, bis(2-methylpropyl)-
CID 77622
Phosphine, dibutyl-
CID 74419
Tripropylphosphine
CID 75226

Frequently Asked Questions

What is the IUPAC name of tert-butyl-di(propan-2-yl)phosphane?
The IUPAC name of tert-butyl-di(propan-2-yl)phosphane (CID 555002) is tert-butyl-di(propan-2-yl)phosphane.
What is the SMILES notation for tert-butyl-di(propan-2-yl)phosphane?
The canonical SMILES for tert-butyl-di(propan-2-yl)phosphane is CC(C)P(C(C)C)C(C)(C)C.
What is the InChIKey of tert-butyl-di(propan-2-yl)phosphane?
The InChIKey is OLSMQSZDUXXYAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H23P/c1-8(2)11(9(3)4)10(5,6)7/h8-9H,1-7H3.
What are the key properties of tert-butyl-di(propan-2-yl)phosphane?
tert-butyl-di(propan-2-yl)phosphane has a molecular weight of 174.27 g/mol, XLogP of 4.08, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-di(propan-2-yl)phosphane is sourced from PubChem (CID 555002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).