chempirical

Cyanomethylenetributylphosphorane

C14H28NPCAS 157141-27-0241.36 g/mol

Open in Covalent MOL file
PN
Nitrile

Properties

Molecular formula
C14H28NP
Molar mass
241.36 g/mol
Exact mass
241.1959 Da
logP
4.73Crippen estimate
Polar surface area
23.8 Ų
H-bond donors / acceptors
0 / 1
Rotatable bonds
9

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
157141-27-0
SMILES
CCCCP(=CC#N)(CCCC)CCCC
InChIKey
OZMLUMPWPFZWTP-UHFFFAOYSA-N
InChI
InChI=1S/C14H28NP/c1-4-7-11-16(14-10-15,12-8-5-2)13-9-6-3/h14H,4-9,11-13H2,1-3H3

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Work with Cyanomethylenetributylphosphorane

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

Pentanenitrile110-59-836 % similar Tributylphosphine oxide814-29-936 % similar Hexanenitrile628-73-934 % similar Octanenitrile124-12-933 % similar Decanenitrile1975-78-633 % similar Nonanenitrile2243-27-833 % similar Undecanenitrile2244-07-733 % similar Diethyl butylphosphonate2404-75-333 % similar

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

Elsewhere

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