1-chloropentane;2,3-dibromopropylphosphane

C8H18Br2ClP — CID 174871582

IUPAC1-chloropentane;2,3-dibromopropylphosphane
SMILESCCCCCCl.PCC(Br)CBr
InChIInChI=1S/C5H11Cl.C3H7Br2P/c1-2-3-4-5-6;4-1-3(5)2-6/h2-5H2,1H3;3H,1-2,6H2
InChIKeyRFEJLNQOLNHBMN-UHFFFAOYSA-N
MW340.47 g/mol
LogP4.44
Rot. Bonds5

About 1-chloropentane;2,3-dibromopropylphosphane

1-chloropentane;2,3-dibromopropylphosphane (PubChem CID 174871582) has the molecular formula C8H18Br2ClP and a molecular weight of 340.47 g/mol. Its IUPAC name is 1-chloropentane;2,3-dibromopropylphosphane.

Molecular Properties

Compound Name1-chloropentane;2,3-dibromopropylphosphane
PubChem CID174871582
Molecular FormulaC8H18Br2ClP
Molecular Weight340.47 g/mol
Exact Mass337.92
IUPAC Name1-chloropentane;2,3-dibromopropylphosphane
SMILESCCCCCCl.PCC(Br)CBr
InChIInChI=1S/C5H11Cl.C3H7Br2P/c1-2-3-4-5-6;4-1-3(5)2-6/h2-5H2,1H3;3H,1-2,6H2
InChIKeyRFEJLNQOLNHBMN-UHFFFAOYSA-N
XLogP4.44
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.47
LogP ≤ 54.44
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': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

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1-chloropentane;2-methylpropane
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1-chloropentadecane
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1-chlorononane
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1-chloropentane;tetracosane
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1-chloropentane;octacosane
CID 174937871
1-chloropentane;pentadecane
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1-chloropentane;2-methylpropane;hydrobromide
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CID 87162953
CID 87162953
1-chloropentane;zirconium;octahydrate
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Frequently Asked Questions

What is the IUPAC name of 1-chloropentane;2,3-dibromopropylphosphane?
The IUPAC name of 1-chloropentane;2,3-dibromopropylphosphane (CID 174871582) is 1-chloropentane;2,3-dibromopropylphosphane.
What is the SMILES notation for 1-chloropentane;2,3-dibromopropylphosphane?
The canonical SMILES for 1-chloropentane;2,3-dibromopropylphosphane is CCCCCCl.PCC(Br)CBr.
What is the InChIKey of 1-chloropentane;2,3-dibromopropylphosphane?
The InChIKey is RFEJLNQOLNHBMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11Cl.C3H7Br2P/c1-2-3-4-5-6;4-1-3(5)2-6/h2-5H2,1H3;3H,1-2,6H2.
What are the key properties of 1-chloropentane;2,3-dibromopropylphosphane?
1-chloropentane;2,3-dibromopropylphosphane has a molecular weight of 340.47 g/mol, XLogP of 4.44, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloropentane;2,3-dibromopropylphosphane is sourced from PubChem (CID 174871582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).