[[dimethylalumanyl(diphenylphosphanyl)amino]-phenylphosphanyl]benzene

C26H26AlNP2 — CID 16695591

IUPAC[[dimethylalumanyl(diphenylphosphanyl)amino]-phenylphosphanyl]benzene
SMILESC[Al](C)N(P(c1ccccc1)c1ccccc1)P(c1ccccc1)c1ccccc1
InChIInChI=1S/C24H20NP2.2CH3.Al/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;2*1H3;/q-1;;;+1
InChIKeyVHWDSWGXFZNETH-UHFFFAOYSA-N
MW441.43 g/mol
LogP5.64
Rot. Bonds7

About [[dimethylalumanyl(diphenylphosphanyl)amino]-phenylphosphanyl]benzene

[[dimethylalumanyl(diphenylphosphanyl)amino]-phenylphosphanyl]benzene (PubChem CID 16695591) has the molecular formula C26H26AlNP2 and a molecular weight of 441.43 g/mol. Its IUPAC name is [[dimethylalumanyl(diphenylphosphanyl)amino]-phenylphosphanyl]benzene.

Molecular Properties

Compound Name[[dimethylalumanyl(diphenylphosphanyl)amino]-phenylphosphanyl]benzene
PubChem CID16695591
Molecular FormulaC26H26AlNP2
Molecular Weight441.43 g/mol
Exact Mass441.14
IUPAC Name[[dimethylalumanyl(diphenylphosphanyl)amino]-phenylphosphanyl]benzene
SMILESC[Al](C)N(P(c1ccccc1)c1ccccc1)P(c1ccccc1)c1ccccc1
InChIInChI=1S/C24H20NP2.2CH3.Al/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;2*1H3;/q-1;;;+1
InChIKeyVHWDSWGXFZNETH-UHFFFAOYSA-N
XLogP5.64
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500441.43
LogP ≤ 55.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-N,1-N,4-N,4-N-tetrakis(diphenylphosphanyl)benzene-1,4-diamine
CID 11423026
(1S)-N,N-bis(diphenylphosphanyl)-1-phenylethanamine
CID 11225572
ethane;triphenylphosphane
CID 90942156
bis(dimethylsilyl)-phenylphosphane
CID 173178751
N-dimethylalumanyl-N-phenylaniline
CID 16714392
N-diphenylphosphanyl-N-diphenylphosphinothioylmethanamine
CID 23415829
1-N,1-N,4-N,4-N-tetrakis(diphenylphosphanyl)cyclohexane-1,4-diamine
CID 118617411
N,N-bis(diphenylphosphanyl)-3,4-dimethoxyaniline
CID 101498808
triphenylphosphane
CID 139056248
borane;methyl(diphenyl)phosphane
CID 13485169
3-[dimethylamino(phenyl)phosphanyl]-N,N-bis(trimethylsilyl)aniline
CID 10834173
N,N-bis(diphenylphosphanyl)hexan-1-amine
CID 88592099

Frequently Asked Questions

What is the IUPAC name of [[dimethylalumanyl(diphenylphosphanyl)amino]-phenylphosphanyl]benzene?
The IUPAC name of [[dimethylalumanyl(diphenylphosphanyl)amino]-phenylphosphanyl]benzene (CID 16695591) is [[dimethylalumanyl(diphenylphosphanyl)amino]-phenylphosphanyl]benzene.
What is the SMILES notation for [[dimethylalumanyl(diphenylphosphanyl)amino]-phenylphosphanyl]benzene?
The canonical SMILES for [[dimethylalumanyl(diphenylphosphanyl)amino]-phenylphosphanyl]benzene is C[Al](C)N(P(c1ccccc1)c1ccccc1)P(c1ccccc1)c1ccccc1.
What is the InChIKey of [[dimethylalumanyl(diphenylphosphanyl)amino]-phenylphosphanyl]benzene?
The InChIKey is VHWDSWGXFZNETH-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20NP2.2CH3.Al/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;2*1H3;/q-1;;;+1.
What are the key properties of [[dimethylalumanyl(diphenylphosphanyl)amino]-phenylphosphanyl]benzene?
[[dimethylalumanyl(diphenylphosphanyl)amino]-phenylphosphanyl]benzene has a molecular weight of 441.43 g/mol, XLogP of 5.64, 7 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [[dimethylalumanyl(diphenylphosphanyl)amino]-phenylphosphanyl]benzene is sourced from PubChem (CID 16695591), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).