4-[(2-diphenylphosphanylphenyl)-dimethylgermyl]-N,N-dimethylaniline

C28H30GeNP — CID 177499264

IUPAC4-[(2-diphenylphosphanylphenyl)-dimethylgermyl]-N,N-dimethylaniline
SMILESCN(C)c1ccc([Ge](C)(C)c2ccccc2P(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C28H30GeNP/c1-29(2,23-19-21-24(22-20-23)30(3)4)27-17-11-12-18-28(27)31(25-13-7-5-8-14-25)26-15-9-6-10-16-26/h5-22H,1-4H3
InChIKeyBZAQQSJBKMAWIO-UHFFFAOYSA-N
MW484.14 g/mol
LogP4.33
Rot. Bonds6

About 4-[(2-diphenylphosphanylphenyl)-dimethylgermyl]-N,N-dimethylaniline

4-[(2-diphenylphosphanylphenyl)-dimethylgermyl]-N,N-dimethylaniline (PubChem CID 177499264) has the molecular formula C28H30GeNP and a molecular weight of 484.14 g/mol. Its IUPAC name is 4-[(2-diphenylphosphanylphenyl)-dimethylgermyl]-N,N-dimethylaniline.

Molecular Properties

Compound Name4-[(2-diphenylphosphanylphenyl)-dimethylgermyl]-N,N-dimethylaniline
PubChem CID177499264
Molecular FormulaC28H30GeNP
Molecular Weight484.14 g/mol
Exact Mass485.13
IUPAC Name4-[(2-diphenylphosphanylphenyl)-dimethylgermyl]-N,N-dimethylaniline
SMILESCN(C)c1ccc([Ge](C)(C)c2ccccc2P(c2ccccc2)c2ccccc2)cc1
InChIInChI=1S/C28H30GeNP/c1-29(2,23-19-21-24(22-20-23)30(3)4)27-17-11-12-18-28(27)31(25-13-7-5-8-14-25)26-15-9-6-10-16-26/h5-22H,1-4H3
InChIKeyBZAQQSJBKMAWIO-UHFFFAOYSA-N
XLogP4.33
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms31
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500484.14
LogP ≤ 54.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-[(2-diphenylphosphanylphenyl)-dimethylgermyl]-N,N-dimethylaniline?
The IUPAC name of 4-[(2-diphenylphosphanylphenyl)-dimethylgermyl]-N,N-dimethylaniline (CID 177499264) is 4-[(2-diphenylphosphanylphenyl)-dimethylgermyl]-N,N-dimethylaniline.
What is the SMILES notation for 4-[(2-diphenylphosphanylphenyl)-dimethylgermyl]-N,N-dimethylaniline?
The canonical SMILES for 4-[(2-diphenylphosphanylphenyl)-dimethylgermyl]-N,N-dimethylaniline is CN(C)c1ccc([Ge](C)(C)c2ccccc2P(c2ccccc2)c2ccccc2)cc1.
What is the InChIKey of 4-[(2-diphenylphosphanylphenyl)-dimethylgermyl]-N,N-dimethylaniline?
The InChIKey is BZAQQSJBKMAWIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H30GeNP/c1-29(2,23-19-21-24(22-20-23)30(3)4)27-17-11-12-18-28(27)31(25-13-7-5-8-14-25)26-15-9-6-10-16-26/h5-22H,1-4H3.
What are the key properties of 4-[(2-diphenylphosphanylphenyl)-dimethylgermyl]-N,N-dimethylaniline?
4-[(2-diphenylphosphanylphenyl)-dimethylgermyl]-N,N-dimethylaniline has a molecular weight of 484.14 g/mol, XLogP of 4.33, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-diphenylphosphanylphenyl)-dimethylgermyl]-N,N-dimethylaniline is sourced from PubChem (CID 177499264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).