1-chloropropylphosphane;hydrochloride

C3H9Cl2P — CID 174764459

IUPAC1-chloropropylphosphane;hydrochloride
SMILESCCC(P)Cl.Cl
InChIInChI=1S/C3H8ClP.ClH/c1-2-3(4)5;/h3H,2,5H2,1H3;1H
InChIKeyVDHCWGMLVMUAMW-UHFFFAOYSA-N
MW146.99 g/mol
LogP2.26
Rot. Bonds1

About 1-chloropropylphosphane;hydrochloride

1-chloropropylphosphane;hydrochloride (PubChem CID 174764459) has the molecular formula C3H9Cl2P and a molecular weight of 146.99 g/mol. Its IUPAC name is 1-chloropropylphosphane;hydrochloride.

Molecular Properties

Compound Name1-chloropropylphosphane;hydrochloride
PubChem CID174764459
Molecular FormulaC3H9Cl2P
Molecular Weight146.99 g/mol
Exact Mass145.98
IUPAC Name1-chloropropylphosphane;hydrochloride
SMILESCCC(P)Cl.Cl
InChIInChI=1S/C3H8ClP.ClH/c1-2-3(4)5;/h3H,2,5H2,1H3;1H
InChIKeyVDHCWGMLVMUAMW-UHFFFAOYSA-N
XLogP2.26
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.99
LogP ≤ 52.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 1-chloropropylphosphane;hydrochloride with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

butan-2-ylphosphane;hydrochloride
CID 174764071
(1R)-1-N',1-N'-dimethylpropane-1,1-diamine
CID 92569177
1-chloropropan-1-amine;N,N-dimethylmethanamine
CID 87947838
N-(2-chloropropyl)-N-methylbutan-2-amine
CID 79445031
2-chlorobutane;silane
CID 174414093
(1S)-1-chloropropan-1-amine
CID 137374711
1-chloro-1-fluoropropane;hydrofluoride
CID 174905950
methanol;1-phosphanylpropan-1-ol
CID 89485594
1-iodopropylphosphane;hydroiodide
CID 173025717
1,1,2-trichlorobutane
CID 19865249
1-chloro-1-(1-chloropropoxy)propane
CID 20501667
3,5,7,9-tetrachloroundecane
CID 20749072

Frequently Asked Questions

What is the IUPAC name of 1-chloropropylphosphane;hydrochloride?
The IUPAC name of 1-chloropropylphosphane;hydrochloride (CID 174764459) is 1-chloropropylphosphane;hydrochloride.
What is the SMILES notation for 1-chloropropylphosphane;hydrochloride?
The canonical SMILES for 1-chloropropylphosphane;hydrochloride is CCC(P)Cl.Cl.
What is the InChIKey of 1-chloropropylphosphane;hydrochloride?
The InChIKey is VDHCWGMLVMUAMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8ClP.ClH/c1-2-3(4)5;/h3H,2,5H2,1H3;1H.
What are the key properties of 1-chloropropylphosphane;hydrochloride?
1-chloropropylphosphane;hydrochloride has a molecular weight of 146.99 g/mol, XLogP of 2.26, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-chloropropylphosphane;hydrochloride is sourced from PubChem (CID 174764459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).