hydroxy-(2,3,4-triphenylphenyl)phosphanium bromide

C24H20BrOP — CID 159320906

IUPAChydroxy-(2,3,4-triphenylphenyl)phosphanium bromide
SMILESO[PH2+]c1ccc(-c2ccccc2)c(-c2ccccc2)c1-c1ccccc1.[Br-]
InChIInChI=1S/C24H19OP.BrH/c25-26-22-17-16-21(18-10-4-1-5-11-18)23(19-12-6-2-7-13-19)24(22)20-14-8-3-9-15-20;/h1-17,25-26H;1H
InChIKeyLDTDXBPBUUPBOU-UHFFFAOYSA-N
MW435.30 g/mol
LogP2.63
Rot. Bonds4

About hydroxy-(2,3,4-triphenylphenyl)phosphanium bromide

hydroxy-(2,3,4-triphenylphenyl)phosphanium bromide (PubChem CID 159320906) has the molecular formula C24H20BrOP and a molecular weight of 435.30 g/mol. Its IUPAC name is hydroxy-(2,3,4-triphenylphenyl)phosphanium bromide.

Molecular Properties

Compound Namehydroxy-(2,3,4-triphenylphenyl)phosphanium bromide
PubChem CID159320906
Molecular FormulaC24H20BrOP
Molecular Weight435.30 g/mol
Exact Mass434.04
IUPAC Namehydroxy-(2,3,4-triphenylphenyl)phosphanium bromide
SMILESO[PH2+]c1ccc(-c2ccccc2)c(-c2ccccc2)c1-c1ccccc1.[Br-]
InChIInChI=1S/C24H19OP.BrH/c25-26-22-17-16-21(18-10-4-1-5-11-18)23(19-12-6-2-7-13-19)24(22)20-14-8-3-9-15-20;/h1-17,25-26H;1H
InChIKeyLDTDXBPBUUPBOU-UHFFFAOYSA-N
XLogP2.63
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500435.30
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1,4-bis(4-methylphenyl)-2,3-diphenylbenzene
CID 123305097
bromo-(2,3,4-triphenylphenyl)phosphinous acid
CID 142735464
ruthenium;(2,3,4-triphenylphenyl)phosphane
CID 161293596
1,2,3,4-tetraphenylbenzene;triazine
CID 175536377
1,2-diphenylnaphthalene
CID 11208267
boric acid;diphenyl-(2,3,4-triphenylphenyl)phosphane
CID 159748341
(2,3,4-triphenylphenyl)hydrazine
CID 67058028
1,2,3-triphenyl-4-(trichloromethyl)benzene
CID 57019840
6-chloro-2,3-diphenylphenol
CID 174572078
1-(bromomethyl)-2,3,4-triphenylbenzene;phosphane
CID 87586907
3-[3,4-diphenyl-2-[4-(2,3,6-triphenylphenyl)phenyl]phenyl]benzenethiol
CID 70842936
2,4,6-tris(2,3-diphenylphenyl)-1,3,5-triazine
CID 171052343

Frequently Asked Questions

What is the IUPAC name of hydroxy-(2,3,4-triphenylphenyl)phosphanium bromide?
The IUPAC name of hydroxy-(2,3,4-triphenylphenyl)phosphanium bromide (CID 159320906) is hydroxy-(2,3,4-triphenylphenyl)phosphanium bromide.
What is the SMILES notation for hydroxy-(2,3,4-triphenylphenyl)phosphanium bromide?
The canonical SMILES for hydroxy-(2,3,4-triphenylphenyl)phosphanium bromide is O[PH2+]c1ccc(-c2ccccc2)c(-c2ccccc2)c1-c1ccccc1.[Br-].
What is the InChIKey of hydroxy-(2,3,4-triphenylphenyl)phosphanium bromide?
The InChIKey is LDTDXBPBUUPBOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H19OP.BrH/c25-26-22-17-16-21(18-10-4-1-5-11-18)23(19-12-6-2-7-13-19)24(22)20-14-8-3-9-15-20;/h1-17,25-26H;1H.
What are the key properties of hydroxy-(2,3,4-triphenylphenyl)phosphanium bromide?
hydroxy-(2,3,4-triphenylphenyl)phosphanium bromide has a molecular weight of 435.30 g/mol, XLogP of 2.63, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for hydroxy-(2,3,4-triphenylphenyl)phosphanium bromide is sourced from PubChem (CID 159320906), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).