4-iodobutylphosphane

C4H10IP — CID 89165611

IUPAC4-iodobutylphosphane
SMILESPCCCCI
InChIInChI=1S/C4H10IP/c5-3-1-2-4-6/h1-4,6H2
InChIKeyMAYIRLHSEHUKLV-UHFFFAOYSA-N
MW216.00 g/mol
LogP2.08
Rot. Bonds3

About 4-iodobutylphosphane

4-iodobutylphosphane (PubChem CID 89165611) has the molecular formula C4H10IP and a molecular weight of 216.00 g/mol. Its IUPAC name is 4-iodobutylphosphane.

Molecular Properties

Compound Name4-iodobutylphosphane
PubChem CID89165611
Molecular FormulaC4H10IP
Molecular Weight216.00 g/mol
Exact Mass215.96
IUPAC Name4-iodobutylphosphane
SMILESPCCCCI
InChIInChI=1S/C4H10IP/c5-3-1-2-4-6/h1-4,6H2
InChIKeyMAYIRLHSEHUKLV-UHFFFAOYSA-N
XLogP2.08
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.00
LogP ≤ 52.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

4-phosphanylbutylphosphane
CID 10986207
1,11-diiodoundecane
CID 4060847
trichloro(25-iodopentacosyl)silane
CID 87682912
17-iodoheptadecan-1-ol
CID 87684669
CID 175765895
CID 175765895
1-bromo-7-iodoheptane
CID 57289617
18-iodooctadecan-1-ol
CID 87686548
6-chlorohexylphosphane
CID 150562107
36-iodohexatriacontan-1-ol
CID 87686395
1-fluoro-12-iodododecane
CID 138596660
17-iodoheptadecane-1-thiol
CID 87685972
chloro-(7-iodoheptyl)-dimethylsilane
CID 87683859

Frequently Asked Questions

What is the IUPAC name of 4-iodobutylphosphane?
The IUPAC name of 4-iodobutylphosphane (CID 89165611) is 4-iodobutylphosphane.
What is the SMILES notation for 4-iodobutylphosphane?
The canonical SMILES for 4-iodobutylphosphane is PCCCCI.
What is the InChIKey of 4-iodobutylphosphane?
The InChIKey is MAYIRLHSEHUKLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10IP/c5-3-1-2-4-6/h1-4,6H2.
What are the key properties of 4-iodobutylphosphane?
4-iodobutylphosphane has a molecular weight of 216.00 g/mol, XLogP of 2.08, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4-iodobutylphosphane is sourced from PubChem (CID 89165611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).