chempirical

(N-Methyl-N-phenylamino)triphenylphosphonium iodide

C25H23INPCAS 34257-63-1495.34 g/mol

Open in Covalent MOL file
NP+I−
Tertiary amine

Properties

Molecular formula
C25H23INP
Molar mass
495.34 g/mol
Exact mass
495.0613 Da
logP
2.04Crippen estimate
Polar surface area
3.2 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
5

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number
34257-63-1
SMILES
CN(C1=CC=CC=C1)[P+](C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4.[I-]
InChIKey
SAYKZWPCENNSDR-UHFFFAOYSA-M
InChI
InChI=1S/C25H23NP.HI/c1-26(22-14-6-2-7-15-22)27(23-16-8-3-9-17-23,24-18-10-4-11-19-24)25-20-12-5-13-21-25;/h2-21H,1H3;1H/q+1;/p-1

Weigh it out

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Work with (N-Methyl-N-phenylamino)triphenylphosphonium iodide

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

Methyltriphenylphosphonium iodide2065-66-945 % similar Tetraphenylphosphonium iodide2065-67-044 % similar Isopropyltriphenylphosphonium iodide24470-78-841 % similar Ethyltriphenylphosphonium iodide4736-60-141 % similar Dimethylaniline121-69-739 % similar N-Methyl-N-phenylbenzenamine552-82-939 % similar (Trimethylsilylmethyl)triphenylphosphonium iodide3739-98-837 % similar N-Methyl-N-nitrosoaniline614-00-636 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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