(2-chlorophenyl)phosphanium bromide

C6H7BrClP — CID 172857362

IUPAC(2-chlorophenyl)phosphanium bromide
SMILES[Br-].[PH3+]c1ccccc1Cl
InChIInChI=1S/C6H6ClP.BrH/c7-5-3-1-2-4-6(5)8;/h1-4H,8H2;1H
InChIKeyYWXFOFSFQTXGCR-UHFFFAOYSA-N
MW225.45 g/mol
LogP-1.42
Rot. Bonds

About (2-chlorophenyl)phosphanium bromide

(2-chlorophenyl)phosphanium bromide (PubChem CID 172857362) has the molecular formula C6H7BrClP and a molecular weight of 225.45 g/mol. Its IUPAC name is (2-chlorophenyl)phosphanium bromide.

Molecular Properties

Compound Name(2-chlorophenyl)phosphanium bromide
PubChem CID172857362
Molecular FormulaC6H7BrClP
Molecular Weight225.45 g/mol
Exact Mass223.92
IUPAC Name(2-chlorophenyl)phosphanium bromide
SMILES[Br-].[PH3+]c1ccccc1Cl
InChIInChI=1S/C6H6ClP.BrH/c7-5-3-1-2-4-6(5)8;/h1-4H,8H2;1H
InChIKeyYWXFOFSFQTXGCR-UHFFFAOYSA-N
XLogP-1.42
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.45
LogP ≤ 5-1.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

azane;1,2-dichlorobenzene
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1,2-dichlorobenzene;hydrate;hydrochloride
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CID 175431484
1,2-dichlorobenzene;naphthalene
CID 162050769
carbon monoxide;chromium;1,2-dichlorobenzene
CID 10924039
2,7-dichlorocyclohepta-2,4,6-trien-1-one
CID 101073282
chlorobenzene;1,2-dichlorobenzene
CID 22250607
1,2-dichlorobenzene;ethoxyethane
CID 68845412
CID 88515237
CID 88515237
(2-chlorophenyl)chloranium
CID 147782481
(2-chlorophenyl)azanide
CID 101489883
(2-chlorophenyl)iodanium
CID 18427197

Frequently Asked Questions

What is the IUPAC name of (2-chlorophenyl)phosphanium bromide?
The IUPAC name of (2-chlorophenyl)phosphanium bromide (CID 172857362) is (2-chlorophenyl)phosphanium bromide.
What is the SMILES notation for (2-chlorophenyl)phosphanium bromide?
The canonical SMILES for (2-chlorophenyl)phosphanium bromide is [Br-].[PH3+]c1ccccc1Cl.
What is the InChIKey of (2-chlorophenyl)phosphanium bromide?
The InChIKey is YWXFOFSFQTXGCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6ClP.BrH/c7-5-3-1-2-4-6(5)8;/h1-4H,8H2;1H.
What are the key properties of (2-chlorophenyl)phosphanium bromide?
(2-chlorophenyl)phosphanium bromide has a molecular weight of 225.45 g/mol, XLogP of -1.42, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2-chlorophenyl)phosphanium bromide is sourced from PubChem (CID 172857362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).