dichloro(heptyl)phosphane

C7H15Cl2P — CID 57297931

IUPACdichloro(heptyl)phosphane
SMILESCCCCCCCP(Cl)Cl
InChIInChI=1S/C7H15Cl2P/c1-2-3-4-5-6-7-10(8)9/h2-7H2,1H3
InChIKeyKGQGBXLQFDXCDB-UHFFFAOYSA-N
MW201.08 g/mol
LogP4.75
Rot. Bonds6

About dichloro(heptyl)phosphane

dichloro(heptyl)phosphane (PubChem CID 57297931) has the molecular formula C7H15Cl2P and a molecular weight of 201.08 g/mol. Its IUPAC name is dichloro(heptyl)phosphane.

Molecular Properties

Compound Namedichloro(heptyl)phosphane
PubChem CID57297931
Molecular FormulaC7H15Cl2P
Molecular Weight201.08 g/mol
Exact Mass200.03
IUPAC Namedichloro(heptyl)phosphane
SMILESCCCCCCCP(Cl)Cl
InChIInChI=1S/C7H15Cl2P/c1-2-3-4-5-6-7-10(8)9/h2-7H2,1H3
InChIKeyKGQGBXLQFDXCDB-UHFFFAOYSA-N
XLogP4.75
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.08
LogP ≤ 54.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

chloro-hexyl-tetradecylphosphane
CID 141135276
octacosane;sulfane
CID 157204687
4-dihexylphosphanylbutyl(dihexyl)phosphane
CID 90109945
hexyl-octyl-pentylphosphane
CID 90108526
bismuthane;trioctylphosphane
CID 174398286
dibutyl(decyl)phosphane
CID 171559269
dodecane;trioctylphosphane;dihydrobromide
CID 173344161
hexyl-methyl-octylphosphane
CID 22497581
diheptyl(methyl)phosphane
CID 22497718
2-dioctadecylphosphanylethyl(dioctadecyl)phosphane
CID 21448799
2-diheptylphosphanylethyl(diheptyl)phosphane
CID 90110075
tris(trioctylphosphane);tungsten
CID 158972203

Frequently Asked Questions

What is the IUPAC name of dichloro(heptyl)phosphane?
The IUPAC name of dichloro(heptyl)phosphane (CID 57297931) is dichloro(heptyl)phosphane.
What is the SMILES notation for dichloro(heptyl)phosphane?
The canonical SMILES for dichloro(heptyl)phosphane is CCCCCCCP(Cl)Cl.
What is the InChIKey of dichloro(heptyl)phosphane?
The InChIKey is KGQGBXLQFDXCDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15Cl2P/c1-2-3-4-5-6-7-10(8)9/h2-7H2,1H3.
What are the key properties of dichloro(heptyl)phosphane?
dichloro(heptyl)phosphane has a molecular weight of 201.08 g/mol, XLogP of 4.75, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dichloro(heptyl)phosphane is sourced from PubChem (CID 57297931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).