chloro(prop-2-enoxy)phosphane

C3H6ClOP — CID 173268880

IUPACchloro(prop-2-enoxy)phosphane
SMILESC=CCOPCl
InChIInChI=1S/C3H6ClOP/c1-2-3-5-6-4/h2,6H,1,3H2
InChIKeyREAKBCPOIPJVQD-UHFFFAOYSA-N
MW124.51 g/mol
LogP1.94
Rot. Bonds3

About chloro(prop-2-enoxy)phosphane

chloro(prop-2-enoxy)phosphane (PubChem CID 173268880) has the molecular formula C3H6ClOP and a molecular weight of 124.51 g/mol. Its IUPAC name is chloro(prop-2-enoxy)phosphane.

Molecular Properties

Compound Namechloro(prop-2-enoxy)phosphane
PubChem CID173268880
Molecular FormulaC3H6ClOP
Molecular Weight124.51 g/mol
Exact Mass123.98
IUPAC Namechloro(prop-2-enoxy)phosphane
SMILESC=CCOPCl
InChIInChI=1S/C3H6ClOP/c1-2-3-5-6-4/h2,6H,1,3H2
InChIKeyREAKBCPOIPJVQD-UHFFFAOYSA-N
XLogP1.94
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.51
LogP ≤ 51.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

bis(trimethylsilyl)methyl-prop-2-enoxyphosphane
CID 102232297
Potassium allyloxide
CID 87828396
(1,2,3,4,5-pentamethylcyclopenta-2,4-dien-1-yl)-prop-2-enoxyphosphane
CID 102232293
3-(prop-2-enoxymethylsulfanylmethoxy)prop-1-ene
CID 87996510
CID 173009539
CID 173009539
azane;3-prop-2-enoxyprop-1-ene;hydrochloride
CID 173111955
3-methanidyloxyprop-1-ene;rutherfordium
CID 162454034
3-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-prop-2-enoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]prop-1-ene
CID 58112303
tris(prop-1-ene);3-prop-2-enoxyprop-1-ene
CID 175414947
CID 87625662
CID 87625662
sodium 3-oxidooxyprop-1-ene
CID 173219790
ethenamine;3-prop-2-enoxyprop-1-ene
CID 174942640

Frequently Asked Questions

What is the IUPAC name of chloro(prop-2-enoxy)phosphane?
The IUPAC name of chloro(prop-2-enoxy)phosphane (CID 173268880) is chloro(prop-2-enoxy)phosphane.
What is the SMILES notation for chloro(prop-2-enoxy)phosphane?
The canonical SMILES for chloro(prop-2-enoxy)phosphane is C=CCOPCl.
What is the InChIKey of chloro(prop-2-enoxy)phosphane?
The InChIKey is REAKBCPOIPJVQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6ClOP/c1-2-3-5-6-4/h2,6H,1,3H2.
What are the key properties of chloro(prop-2-enoxy)phosphane?
chloro(prop-2-enoxy)phosphane has a molecular weight of 124.51 g/mol, XLogP of 1.94, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for chloro(prop-2-enoxy)phosphane is sourced from PubChem (CID 173268880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).