CID 11825466

C24H20BP2- — CID 11825466

IUPAC—
SMILES[B-](P(c1ccccc1)c1ccccc1)P(c1ccccc1)c1ccccc1
InChIInChI=1S/C24H20BP2/c1-5-13-21(14-6-1)26(22-15-7-2-8-16-22)25-27(23-17-9-3-10-18-23)24-19-11-4-12-20-24/h1-20H/q-1
InChIKeyUAWFYPWXLQNUSH-UHFFFAOYSA-N
MW381.18 g/mol
LogP4.79
Rot. Bonds6

About CID 11825466

CID 11825466 (PubChem CID 11825466) has the molecular formula C24H20BP2- and a molecular weight of 381.18 g/mol.

Molecular Properties

Compound NameCID 11825466
PubChem CID11825466
Molecular FormulaC24H20BP2-
Molecular Weight381.18 g/mol
Exact Mass381.11
IUPAC Name—
SMILES[B-](P(c1ccccc1)c1ccccc1)P(c1ccccc1)c1ccccc1
InChIInChI=1S/C24H20BP2/c1-5-13-21(14-6-1)26(22-15-7-2-8-16-22)25-27(23-17-9-3-10-18-23)24-19-11-4-12-20-24/h1-20H/q-1
InChIKeyUAWFYPWXLQNUSH-UHFFFAOYSA-N
XLogP4.79
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.18
LogP ≤ 54.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

triphenylphosphane
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tris(triphenylphosphane);trihydrochloride
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tris(triphenylphosphane);hydrobromide
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CID 10122028
triphenylphosphane;yttrium
CID 139917776
tetrakis(triphenylphosphane);dihydrochloride
CID 172855409
copper monohydride;hexakis(triphenylphosphane)
CID 134992255
silane;triphenylphosphane
CID 161037280
plutonium;triphenylphosphane
CID 161300359
iron dihydride;tetrakis(triphenylphosphane)
CID 172730134
CID 87948921
CID 87948921
triphenylphosphane;octahydrochloride
CID 172751742

Frequently Asked Questions

What is the IUPAC name of CID 11825466?
The IUPAC name of CID 11825466 (CID 11825466) is not available.
What is the SMILES notation for CID 11825466?
The canonical SMILES for CID 11825466 is [B-](P(c1ccccc1)c1ccccc1)P(c1ccccc1)c1ccccc1.
What is the InChIKey of CID 11825466?
The InChIKey is UAWFYPWXLQNUSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20BP2/c1-5-13-21(14-6-1)26(22-15-7-2-8-16-22)25-27(23-17-9-3-10-18-23)24-19-11-4-12-20-24/h1-20H/q-1.
What are the key properties of CID 11825466?
CID 11825466 has a molecular weight of 381.18 g/mol, XLogP of 4.79, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for CID 11825466 is sourced from PubChem (CID 11825466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).