(1,2-dichloro-2-phenylphosphanylethyl)-phenylphosphane

C14H14Cl2P2 — CID 150718594

IUPAC(1,2-dichloro-2-phenylphosphanylethyl)-phenylphosphane
SMILESClC(Pc1ccccc1)C(Cl)Pc1ccccc1
InChIInChI=1S/C14H14Cl2P2/c15-13(17-11-7-3-1-4-8-11)14(16)18-12-9-5-2-6-10-12/h1-10,13-14,17-18H
InChIKeyJPJUCIIHRSGZDW-UHFFFAOYSA-N
MW315.12 g/mol
LogP4.12
Rot. Bonds5

About (1,2-dichloro-2-phenylphosphanylethyl)-phenylphosphane

(1,2-dichloro-2-phenylphosphanylethyl)-phenylphosphane (PubChem CID 150718594) has the molecular formula C14H14Cl2P2 and a molecular weight of 315.12 g/mol. Its IUPAC name is (1,2-dichloro-2-phenylphosphanylethyl)-phenylphosphane.

Molecular Properties

Compound Name(1,2-dichloro-2-phenylphosphanylethyl)-phenylphosphane
PubChem CID150718594
Molecular FormulaC14H14Cl2P2
Molecular Weight315.12 g/mol
Exact Mass313.99
IUPAC Name(1,2-dichloro-2-phenylphosphanylethyl)-phenylphosphane
SMILESClC(Pc1ccccc1)C(Cl)Pc1ccccc1
InChIInChI=1S/C14H14Cl2P2/c15-13(17-11-7-3-1-4-8-11)14(16)18-12-9-5-2-6-10-12/h1-10,13-14,17-18H
InChIKeyJPJUCIIHRSGZDW-UHFFFAOYSA-N
XLogP4.12
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.12
LogP ≤ 54.12
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'}

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Related Compounds

Chlorodiphenylphosphine
CID 66180
Diphenylphosphine
CID 70017
Allyldiphenylphosphine
CID 137699
Ethylenebis[phenylphosphine]
CID 3316746
Diphenylvinylphosphine
CID 75083
1,3-Bis(phenylphosphino)propane
CID 4366891
Diphenyl(2-phosphinoethyl)phosphine
CID 118711
2-Chloroethyltriphenylphosphonium bromide
CID 3084530
Benzene, mixt. with 1,2-dichloroethane
CID 6453035
Allenyldiphenylphosphine
CID 15397612
2-Chloroethyldiphenylphosphine
CID 253989
Phosphine, (3-chloropropyl)diphenyl-
CID 608029

Frequently Asked Questions

What is the IUPAC name of (1,2-dichloro-2-phenylphosphanylethyl)-phenylphosphane?
The IUPAC name of (1,2-dichloro-2-phenylphosphanylethyl)-phenylphosphane (CID 150718594) is (1,2-dichloro-2-phenylphosphanylethyl)-phenylphosphane.
What is the SMILES notation for (1,2-dichloro-2-phenylphosphanylethyl)-phenylphosphane?
The canonical SMILES for (1,2-dichloro-2-phenylphosphanylethyl)-phenylphosphane is ClC(Pc1ccccc1)C(Cl)Pc1ccccc1.
What is the InChIKey of (1,2-dichloro-2-phenylphosphanylethyl)-phenylphosphane?
The InChIKey is JPJUCIIHRSGZDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14Cl2P2/c15-13(17-11-7-3-1-4-8-11)14(16)18-12-9-5-2-6-10-12/h1-10,13-14,17-18H.
What are the key properties of (1,2-dichloro-2-phenylphosphanylethyl)-phenylphosphane?
(1,2-dichloro-2-phenylphosphanylethyl)-phenylphosphane has a molecular weight of 315.12 g/mol, XLogP of 4.12, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1,2-dichloro-2-phenylphosphanylethyl)-phenylphosphane is sourced from PubChem (CID 150718594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).