tert-butyl-iodo-propan-2-ylphosphane

C7H16IP — CID 15791580

IUPACtert-butyl-iodo-propan-2-ylphosphane
SMILESCC(C)P(I)C(C)(C)C
InChIInChI=1S/C7H16IP/c1-6(2)9(8)7(3,4)5/h6H,1-5H3
InChIKeyNCPVQNZFLSMTOD-UHFFFAOYSA-N
MW258.08 g/mol
LogP4.03
Rot. Bonds1

About tert-butyl-iodo-propan-2-ylphosphane

tert-butyl-iodo-propan-2-ylphosphane (PubChem CID 15791580) has the molecular formula C7H16IP and a molecular weight of 258.08 g/mol. Its IUPAC name is tert-butyl-iodo-propan-2-ylphosphane.

Molecular Properties

Compound Nametert-butyl-iodo-propan-2-ylphosphane
PubChem CID15791580
Molecular FormulaC7H16IP
Molecular Weight258.08 g/mol
Exact Mass258.00
IUPAC Nametert-butyl-iodo-propan-2-ylphosphane
SMILESCC(C)P(I)C(C)(C)C
InChIInChI=1S/C7H16IP/c1-6(2)9(8)7(3,4)5/h6H,1-5H3
InChIKeyNCPVQNZFLSMTOD-UHFFFAOYSA-N
XLogP4.03
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.08
LogP ≤ 54.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

2-di(propan-2-yl)phosphanylpropan-2-yl-di(propan-2-yl)phosphane
CID 89346513
diiodo(propan-2-yloxy)phosphane
CID 12507744
tert-butyl-[2-[tert-butyl(2-methylpropyl)phosphanyl]ethyl]-(2-methylpropyl)phosphane
CID 23501433
ditert-butyl-[2-[tert-butyl(iodo)phosphanyl]ethyl]-iodophosphanium iodide
CID 139169212
4-iodo-N,4-dimethylpentan-2-amine
CID 88918834
1-chloro-2,2-dimethylpropane;iodomethane
CID 87343614
2-methylbutan-2-yl-di(propan-2-yl)phosphane
CID 87456053
tert-butyl-di(propan-2-yloxy)phosphane
CID 12929625
tert-butyl-[6-[tert-butyl(methyl)phosphanyl]hexyl]-methylphosphane
CID 177390935
dimethyl-[(Z)-4,4,5-trimethylhex-1-enyl]phosphane
CID 175621470
2-[tert-butyl(methyl)phosphanyl]ethanol
CID 87760818
2,2,3-trimethyl-1-methylsulfanylbutane
CID 123569851

Frequently Asked Questions

What is the IUPAC name of tert-butyl-iodo-propan-2-ylphosphane?
The IUPAC name of tert-butyl-iodo-propan-2-ylphosphane (CID 15791580) is tert-butyl-iodo-propan-2-ylphosphane.
What is the SMILES notation for tert-butyl-iodo-propan-2-ylphosphane?
The canonical SMILES for tert-butyl-iodo-propan-2-ylphosphane is CC(C)P(I)C(C)(C)C.
What is the InChIKey of tert-butyl-iodo-propan-2-ylphosphane?
The InChIKey is NCPVQNZFLSMTOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16IP/c1-6(2)9(8)7(3,4)5/h6H,1-5H3.
What are the key properties of tert-butyl-iodo-propan-2-ylphosphane?
tert-butyl-iodo-propan-2-ylphosphane has a molecular weight of 258.08 g/mol, XLogP of 4.03, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl-iodo-propan-2-ylphosphane is sourced from PubChem (CID 15791580), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).